N-Methyloctadecylamine
PubChem CID: 75539
Connections displayed (default: 10).
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| Compound Synonyms | N-Methyloctadecylamine, N-Methyl-N-octadecylamine, 2439-55-6, N-methyloctadecan-1-amine, Methyloctadecylamine, N-Methylstearylamine, 1-Octadecanamine, N-methyl-, Octadecylmethylamine, Methylstearylamine, N-Methyl-N-stearylamine, N-Stearyl-N-methylamine, N-Methyloctadecanamine, N-Methyl-1-octadecanamine, Octadecylamine, N-methyl-, Methyl-n-octadecylamine, N-octadecylmethylamine, NSC 66468, UNII-VII03N5WBX, VII03N5WBX, EINECS 219-463-7, BRN 1758431, Methyl-octadecyl-amine, NSC-66468, DTXSID50870977, 4-04-00-00827 (Beilstein Handbook Reference), NSC66468, methyl octadecylamine, MFCD00009008, methyl(octadecyl)amine, N-methyl-octadecylamine, N-methyl-N-octadecyl amine, N-methyl-N-n-octadecylamine, SCHEMBL37402, N-Methyloctadecylamine, 98%, DTXCID10818653, ALBB-030092, STK286090, AKOS003386030, FM71629, AS-58522, DB-046432, CS-0315017, M0912, NS00046934, D91402, Q27291849, 219-463-7 |
|---|---|
| Topological Polar Surface Area | 12.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 156.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | N-methyloctadecan-1-amine |
| Prediction Hob | 0.0 |
| Xlogp | 8.6 |
| Molecular Formula | C19H41N |
| Prediction Swissadme | 0.0 |
| Inchi Key | SZEGKVHRCLBFKJ-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -3.111 |
| Rotatable Bond Count | 17.0 |
| Logd | 2.346 |
| Compound Name | N-Methyloctadecylamine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 283.324 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 283.324 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 283.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.799472799999998 |
| Inchi | InChI=1S/C19H41N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-2/h20H,3-19H2,1-2H3 |
| Smiles | CCCCCCCCCCCCCCCCCCNC |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Hypericum Japonicum (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Thymus Quinquecostatus (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Thymus Vulgaris (Plant) Rel Props:Source_db:cmaup_ingredients