1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide

C23H28N2O3 — CID 110307099

IUPAC1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
SMILESCOc1ccc(CCN(C)C(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C23H28N2O3/c1-24(15-12-18-8-10-21(28-2)11-9-18)22(26)20-13-16-25(17-14-20)23(27)19-6-4-3-5-7-19/h3-11,20H,12-17H2,1-2H3
InChIKeyIGVPFGLOQRITLY-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.25
Rot. Bonds6

About 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide

1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide (PubChem CID 110307099) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
PubChem CID110307099
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
SMILESCOc1ccc(CCN(C)C(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C23H28N2O3/c1-24(15-12-18-8-10-21(28-2)11-9-18)22(26)20-13-16-25(17-14-20)23(27)19-6-4-3-5-7-19/h3-11,20H,12-17H2,1-2H3
InChIKeyIGVPFGLOQRITLY-UHFFFAOYSA-N
XLogP3.25
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide
CID 110287930
1-(3,5-dimethoxybenzoyl)-N-[(4-methoxyphenyl)methyl]-N-methylpiperidine-4-carboxamide
CID 55719859
4-[(1-benzoylpiperidine-4-carbonyl)-methylamino]butanoic acid
CID 119173154
1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide
CID 113005887
1-benzoyl-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
CID 110308753
N-(3-amino-4-methylpentyl)-1-benzoyl-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119659992
N-[(4-methoxyphenyl)methyl]-N-methyl-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 55631044
[4-(4-methoxybenzoyl)piperazin-1-yl]-phenylmethanone
CID 3150576
1-[3-(4-methoxyphenyl)propanoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 110350832
1-benzoyl-N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carboxamide
CID 136528098
N-[(4-methoxyphenyl)methyl]-N-methyl-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide
CID 24641378
N-benzyl-1-(4-chlorobenzoyl)-N-methylpiperidine-4-carboxamide
CID 17119215

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide (CID 110307099) is 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide is COc1ccc(CCN(C)C(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1.
What is the InChIKey of 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide?
The InChIKey is IGVPFGLOQRITLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-24(15-12-18-8-10-21(28-2)11-9-18)22(26)20-13-16-25(17-14-20)23(27)19-6-4-3-5-7-19/h3-11,20H,12-17H2,1-2H3.
What are the key properties of 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide?
1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 3.25, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 110307099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).