Basic information
- CAS
102395-79-9- Standard SMILES
CC(CO)NC(=O)C1CCN(Cc2c[nH]c3ccccc23)CC1- InChIKey
MINFLCSDCVZVKX-ZDUSSCGKSA-N- Molecular formula
- C18H25N3O2
- Average molar mass
- 315.4 g/mol
- Monoisotopic mass
- 315.19467705
Names & identifiers
- Preferred name
- Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-
- IUPAC
- N-(1-hydroxypropan-2-yl)-1-(1H-indol-3-ylmethyl)piperidine-4-carboxamide
- English name
- L-2-(1-Skatyl-4-isonipecotamido)-1-propanol
- Molecular formula
- C18H25N3O2
- Molecular weight
- 315.414
Names & synonyms
Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-RefChem:1087630L-N-(1-Hydroxy-2-propyl)-1-(3-indolylmethyl)isonipecotamide102395-79-9BRN 0042768L-2-(1-Skatyl-4-isonipecotamido)-1-propanolN-(1-hydroxypropan-2-yl)-1-(1H-indol-3-ylmethyl)piperidine-4-carboxamideISONIPECOTAMIDE, N-(1-HYDROXY-2-PROPYL)-1-(3-INDOLYLMETHYL)-, L-4-22-00-04313 (Beilstein Handbook Reference)NIOSH/NS5030000DTXSID30907472NS50300000
Show more names
N-(2-Hydroxy-1-methylethyl)-1-(3-indolylmethyl)isonipecotamideN-(1-Hydroxypropan-2-yl)-1-[(1H-indol-3-yl)methyl]piperidine-4-carboximidic acid
Database identifiers
- CAS
102395-79-9- PubChem CID
- 59345
- DTXSID
DTXSID30907472
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 396
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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