N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide

C22H34N2O — CID 24776411

IUPACN-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCNC(=O)C1(c2ccccc2)CCN(C2CCC(C(C)C)CC2)CC1
InChIInChI=1S/C22H34N2O/c1-17(2)18-9-11-20(12-10-18)24-15-13-22(14-16-24,21(25)23-3)19-7-5-4-6-8-19/h4-8,17-18,20H,9-16H2,1-3H3,(H,23,25)
InChIKeyMBUHOVJAFHBTTO-UHFFFAOYSA-N
MW342.53 g/mol
LogP3.98
Rot. Bonds4

About N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide

N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide (PubChem CID 24776411) has the molecular formula C22H34N2O and a molecular weight of 342.53 g/mol. Its IUPAC name is N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
PubChem CID24776411
Molecular FormulaC22H34N2O
Molecular Weight342.53 g/mol
Exact Mass342.27
IUPAC NameN-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCNC(=O)C1(c2ccccc2)CCN(C2CCC(C(C)C)CC2)CC1
InChIInChI=1S/C22H34N2O/c1-17(2)18-9-11-20(12-10-18)24-15-13-22(14-16-24,21(25)23-3)19-7-5-4-6-8-19/h4-8,17-18,20H,9-16H2,1-3H3,(H,23,25)
InChIKeyMBUHOVJAFHBTTO-UHFFFAOYSA-N
XLogP3.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.53
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-4-(4-fluorophenyl)-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
CID 24799848
4-(4-fluorophenyl)-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxylic acid
CID 24799142
1-(3-methylcyclobutyl)-4-phenylpiperidine-4-carboxylic acid
CID 103565171
1-phenyl-7-(4-propan-2-ylcyclohexyl)-1,7-diazaspiro[3.5]nonan-2-one;hydrochloride
CID 23298886
1-cyclopropyl-4-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 134218287
4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine
CID 142115785
[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 103677890
1-[4-(1,1-dioxo-1,4-thiazinan-4-yl)piperidine-1-carbonyl]-4-phenylpiperidine-4-carboxylic acid
CID 68513152
4-methoxy-1-phenyl-8-(4-propan-2-ylcyclohexyl)-1,8-diazaspiro[4.5]decane
CID 18002534
1-[2-(methylamino)propanoyl]-4-phenylpiperidine-4-carboxylic acid
CID 62639706
[4-(methylamino)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119560283
N-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-1-phenyl-4-piperazin-1-ylcyclohexane-1-carboxamide
CID 91135831

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The IUPAC name of N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide (CID 24776411) is N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide.
What is the SMILES notation for N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The canonical SMILES for N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide is CNC(=O)C1(c2ccccc2)CCN(C2CCC(C(C)C)CC2)CC1.
What is the InChIKey of N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The InChIKey is MBUHOVJAFHBTTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O/c1-17(2)18-9-11-20(12-10-18)24-15-13-22(14-16-24,21(25)23-3)19-7-5-4-6-8-19/h4-8,17-18,20H,9-16H2,1-3H3,(H,23,25).
What are the key properties of N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide has a molecular weight of 342.53 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide is sourced from PubChem (CID 24776411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).