9H-Pyrido(3,4-b)indole, 3-cyclohexanecarboxamidomethyl-1-methyl-
Basic information
- CAS
63885-52-9- Standard SMILES
Cc1nc(CNC(=O)C2CCCCC2)cc2c1[nH]c1ccccc12- InChIKey
HSYGRYGUMFBRCP-UHFFFAOYSA-N- Molecular formula
- C20H23N3O
- Average molar mass
- 321.4 g/mol
- Monoisotopic mass
- 321.18411237
Names & identifiers
- Preferred name
- 9H-Pyrido(3,4-b)indole, 3-cyclohexanecarboxamidomethyl-1-methyl-
- IUPAC
- N-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)methyl]cyclohexanecarboxamide
- English name
- N-(1-Methyl-9H-pyrido[3,4-b]indol-3-ylmethyl)cyclohexanecarboxamide
- Molecular formula
- C20H23N3O
- Molecular weight
- 321.42
Names & synonyms
GPA 7753-Cyclohexanecarboxamidomethyl harmane63885-52-9BRN 06998869H-Pyrido(3,4-b)indole, 3-cyclohexanecarboxamidomethyl-1-methyl-3-Cyclohexanecarboxamidomethyl-1-methyl-9H-pyrid(3,4-b)indoleDTXSID00213436RefChem:313695DTXCID00135927N-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)methyl]cyclohexanecarboxamideN-(1-methyl-9h-pyrido[3,4-b]indol-3-ylmethyl)cyclohexanecarboxamideDB-308444
Show more names
GPA-775Cyclohexanecarboxamide, N-[(1-methyl-9H-pyrido[3,4-b]indol-3-yl)methyl]-
Database identifiers
- CAS
63885-52-9- PubChem CID
- 5745839
- DTXSID
DTXSID00213436- Nikkaji
- J85.794G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 448
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Compound notes
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