N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide

C22H24N2O3 — CID 113007858

IUPACN-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
SMILESCC(=O)c1ccc(NC(=O)C2CCN(C(=O)c3ccc(C)cc3)CC2)cc1
InChIInChI=1S/C22H24N2O3/c1-15-3-5-19(6-4-15)22(27)24-13-11-18(12-14-24)21(26)23-20-9-7-17(8-10-20)16(2)25/h3-10,18H,11-14H2,1-2H3,(H,23,26)
InChIKeyRQKFDUFKZPHMMT-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.69
Rot. Bonds4

About N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide

N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide (PubChem CID 113007858) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
PubChem CID113007858
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
SMILESCC(=O)c1ccc(NC(=O)C2CCN(C(=O)c3ccc(C)cc3)CC2)cc1
InChIInChI=1S/C22H24N2O3/c1-15-3-5-19(6-4-15)22(27)24-13-11-18(12-14-24)21(26)23-20-9-7-17(8-10-20)16(2)25/h3-10,18H,11-14H2,1-2H3,(H,23,26)
InChIKeyRQKFDUFKZPHMMT-UHFFFAOYSA-N
XLogP3.69
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113006644
1-(4-methylbenzoyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 113006809
N-(4-acetamidophenyl)-1-(4-bromobenzoyl)piperidine-4-carboxamide
CID 35049074
1-(3,4-dimethoxybenzoyl)-N-(4-methylphenyl)piperidine-4-carboxamide
CID 113006178
N-(4-acetylphenyl)-1-methylpiperidine-4-carboxamide
CID 59145520
N-[4-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]phenyl]cyclopropanecarboxamide
CID 24567090
1-(4-acetamidobenzoyl)-N-methylpiperidine-4-carboxamide
CID 20973013
4-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119177742
1-[4-(cyclopropanecarbonylamino)benzoyl]-N-ethylpiperidine-4-carboxamide
CID 32994989
N-[4-(4-acetyl-1,4-diazepane-1-carbonyl)phenyl]cyclopropanecarboxamide
CID 134061665
N-(3-chloro-4-methoxyphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113007389
N-(4-acetylphenyl)-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145710

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide (CID 113007858) is N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide is CC(=O)c1ccc(NC(=O)C2CCN(C(=O)c3ccc(C)cc3)CC2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide?
The InChIKey is RQKFDUFKZPHMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-15-3-5-19(6-4-15)22(27)24-13-11-18(12-14-24)21(26)23-20-9-7-17(8-10-20)16(2)25/h3-10,18H,11-14H2,1-2H3,(H,23,26).
What are the key properties of N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide?
N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 113007858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).