Nanofin
PubChem CID: 68843
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| Compound Synonyms | 2,6-Dimethylpiperidine, 504-03-0, Nanofin, 2,6-Lupetidine, Piperidine, 2,6-dimethyl-, Lupetidine, Naniopinum, Lupetidin, Nanofine, Nanophin, Nanophine, Nanophyn, Naniopine, Nanofina, Nanofin [INN], Nanofinum, Nanofine [INN-French], Nanofinum [INN-Latin], Nanofina [INN-Spanish], 2,6-Dimethyl-Piperidine, EINECS 207-981-6, NSC 63890, NSC-63890, BRN 0079827, UNII-329I5805BP, MFCD00005986, 329I5805BP, DTXSID8048527, 5-20-04-00180 (Beilstein Handbook Reference), Piperidine,6-dimethyl-, Nanofine (INN-French), Nanofinum (INN-Latin), Nanofina (INN-Spanish), trans-2,6-dimethylpiperidine, WLN: T6MTJ B1 F1, 14231-78-8, (2R,6R)-2,6-dimethylpiperidine, hydrochloride, MFCD00066304, 10066-29-2, cis2,6Dimethylpiperidine, 2,6-dimethyl piperidine, SCHEMBL25816, CHEMBL2104431, DTXCID10197036, NSC7513, HMS3886E09, Pharmakon1600-01301019, (2R,6S)-2,6-Dimethylpiperidine, cis-2,6-Dimethylpiperidine, cis-2,6-Lupetidine, meso-2,6-Lupetidine, HY-B1191, NSC-7513, NSC63890, STR03569, NSC760379, s4992, STK386773, AKOS000118813, AKOS016038932, AB02692, AB76289, CCG-213660, CS-4799, NSC-760379, PS-3668, NCGC00263473-02, DA-34973, DA-75988, NS00125249, EN300-19581, F10355, AB01326529-02, AB01326529_03, AG-690/11351775, SR-01000944275, Q4596811, SR-01000944275-1, BRD-A21276153-001-01-1, F2190-0336, Z104474330, 207-981-6 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 12.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCCCC1 |
| Np Classifier Class | Acetate-derived alkaloids, Piperidine alkaloids |
| Deep Smiles | CCCCCCN6)C |
| Heavy Atom Count | 8.0 |
| Classyfire Class | Piperidines |
| Scaffold Graph Node Level | C1CCNCC1 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 62.8 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,6-dimethylpiperidine |
| Veber Rule | True |
| Classyfire Superclass | Organoheterocyclic compounds |
| Xlogp | 1.5 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C7H15N |
| Scaffold Graph Node Bond Level | C1CCNCC1 |
| Inchi Key | SDGKUVSVPIIUCF-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | piperidine-2,6-dimethyl |
| Esol Class | Very soluble |
| Functional Groups | CNC |
| Compound Name | Nanofin |
| Exact Mass | 113.12 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 113.12 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 113.2 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C7H15N/c1-6-4-3-5-7(2)8-6/h6-8H,3-5H2,1-2H3 |
| Smiles | CC1CCCC(N1)C |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Lysine alkaloids, Pseudoalkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Oryza Sativa (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2012.10644099