1-(3-Methylbenzoyl)-3-[2-(2-cyclohexylmethylpiperidino)ethyl]-5-methoxy-2-methylindole

HCID 21313316
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Basic information

Standard SMILES
COc1ccc2c(c1)c(CCN1CCCCC1CC1CCCCC1)c(C)n2C(=O)c1cccc(C)c1
InChIKey
AFAPOVJBDIOLHR-UHFFFAOYSA-N
Molecular formula
C32H42N2O2
Average molar mass
486.7 g/mol
Monoisotopic mass
486.32462859

Names & identifiers

Preferred name
1-(3-Methylbenzoyl)-3-[2-(2-cyclohexylmethylpiperidino)ethyl]-5-methoxy-2-methylindole
IUPAC
[3-[2-[2-(cyclohexylmethyl)piperidin-1-yl]ethyl]-5-methoxy-2-methylindol-1-yl]-(3-methylphenyl)methanone

Names & synonyms

SCHEMBL11521126AFAPOVJBDIOLHR-UHFFFAOYSA-N1-(3-Methylbenzoyl)-3-[2-(2-cyclohexylmethylpiperidino)ethyl]-5-methoxy-2-methylindole

Database identifiers

PubChem CID
21313316

Properties

Computed structural properties

XLogP
8.6
Topological polar surface area
34.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
36

Related reactions

3 records
New reaction record

Linked notes

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