Butylamine
PubChem CID: 8007
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Butylamine, N-BUTYLAMINE, butan-1-amine, 109-73-9, 1-Butanamine, 1-Aminobutane, 1-Butylamine, Monobutylamine, N-Butylamin, Norvalamine, Mono-n-butylamine, 1-Aminobutan, Butanamine, n-butyl amine, 1-Amino-butaan, Monobutilamina, butyl amine, n-Butilamina, Butylamine, n-, FEMA Number 3130, FEMA No. 3130, Norralamine, CCRIS 4756, HSDB 515, UNII-N2QV60B4WR, NSC 8029, EINECS 203-699-2, MFCD00011690, UN1125, DTXSID1021904, CHEBI:43799, AI3-24197, 1-AMINO-BUTANE, NSC-8029, BUTYLAMINE [FHFI], N-BUTYLAMINE [MI], BUTYLAMINE [MART.], n-C4H9NH2, N-BUTYLAMINE [HSDB], N2QV60B4WR, DTXCID501904, EC 203-699-2, butane, 1-amino-, UN 1125, BUTYLAMINE (MART.), n-Butylamin [German], n-Butilamina [Italian], 1-Aminobutan [German], Monobutilamina [Romanian], 1-Amino-butaan [Dutch], Aminobutane, Butylarnine, Mononbutylamine, nButilamina, nButylamin, nButylamine, n-butyiamine, 1Aminobutaan, 1Aminobutan, 1Aminobutane, 1Butanamine, n-butyl-amine, butane-1-amine, n-butan-1-amine, normal-butyl amine, Butylamine, 99%, nBuNH2, Butylamine (OSHA), 1-Butanamine, 9CI, BuNH2, n-BuNH2, BUTYLAMINE, N, Butylamine, >=99%, Butylamine, 99.5%, n-Butylamine (ACGIH), 1-Butanaminen-butilamina, NCIOpen2_009229, WLN: Z4, CHEMBL13968, FEMA NUMBER 3130., Butylamine, puriss., 99.0%, FEMA 3130, NSC8029, STR01992, Tox21_301131, BBL027788, STL308736, AKOS000118810, Butylamine, purum, >=98.0% (GC), Butylamine, purum, >=99.0% (GC), DB03659, Butylamine, analytical reference material, Butylamine, puriss., >=99.5% (GC), NCGC00248302-01, NCGC00255030-01, BP-30251, CAS-109-73-9, B0707, NS00007640, EN300-19577, n-Butylamine [UN1125] [Flammable liquid], Q421035, F2190-0358 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 26.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Deep Smiles | CCCCN |
| Heavy Atom Count | 5.0 |
| Classyfire Class | Organonitrogen compounds |
| Description | Found in mulberry leaves, kale, swede, tomato, wheat bread, cheeses, caviar, raw fatty fish, cooked chicken or beef, beer, cocoa, and other foodstuffs. Flavouring agent |
| Classyfire Subclass | Amines |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 13.1 |
| Database Name | fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | Q03181 |
| Iupac Name | butan-1-amine |
| Class | Amines |
| Veber Rule | True |
| Classyfire Superclass | Organic nitrogen compounds |
| Xlogp | 1.0 |
| Superclass | Organonitrogen compounds |
| Subclass | Primary amines |
| Gsk 4 400 Rule | True |
| Molecular Formula | C4H11N |
| Inchi Key | HQABUPZFAYXKJW-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 2.0 |
| State | Liquid |
| Synonyms | 1-Aminobutan, 1-Aminobutane, 1-Butanamine, 1-Butanamine, 9CI, Aminobutane, Butanamine, Butylamine, FEMA 3130, Mono-N-butylamine, Monobutylamine, N-Butylamin, N-Butylamine, N-C4H9NH2, Norralamine, Norvalamine, mono-N-Butylamine, 1-Butanamine, 9ci, N-Butylamine hydrobromide, N-Butylamine hydrochloride, 14C-labeled CPD, N-Butylamine hydrochloride, 1-Butylamine, butylamine |
| Substituent Name | Hydrocarbon derivative, Primary aliphatic amine, Aliphatic acyclic compound |
| Esol Class | Very soluble |
| Functional Groups | CN |
| Compound Name | Butylamine |
| Kingdom | Organic compounds |
| Exact Mass | 73.0891 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 73.0891 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 73.14 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C4H11N/c1-2-3-4-5/h2-5H2,1H3 |
| Smiles | CCCCN |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Taxonomy Direct Parent | Monoalkylamines |
- 1. Outgoing r'ship
FOUND_INto/from Echinacea Angustifolia (Plant) Rel Props:Reference:ISBN:9780896038776 - 2. Outgoing r'ship
FOUND_INto/from Glycine Max (Plant) Rel Props:Source_db:fooddb_chem_all