2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide

C21H24N2O2 — CID 26037570

IUPAC2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
SMILESO=C(CN1CCC(C(=O)c2ccccc2)CC1)NCc1ccccc1
InChIInChI=1S/C21H24N2O2/c24-20(22-15-17-7-3-1-4-8-17)16-23-13-11-19(12-14-23)21(25)18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,22,24)
InChIKeyYNMHSICYVPINOX-UHFFFAOYSA-N
MW336.44 g/mol
LogP2.90
Rot. Bonds6

About 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide

2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide (PubChem CID 26037570) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide.

Molecular Properties

Compound Name2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
PubChem CID26037570
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
SMILESO=C(CN1CCC(C(=O)c2ccccc2)CC1)NCc1ccccc1
InChIInChI=1S/C21H24N2O2/c24-20(22-15-17-7-3-1-4-8-17)16-23-13-11-19(12-14-23)21(25)18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,22,24)
InChIKeyYNMHSICYVPINOX-UHFFFAOYSA-N
XLogP2.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-benzoylpiperidin-1-yl)-N-prop-2-ynylacetamide
CID 51322931
1-[2-(benzylamino)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
CID 52682822
2-[4-(acetamidomethyl)piperidin-1-yl]-N-benzylacetamide
CID 60510811
N-benzyl-1-[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]piperidine-4-carboxamide
CID 41415384
N-benzyl-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104503
N-benzyl-1-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 86909124
N-benzyl-1-[2-(butylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 27107050
2-(4-benzylpiperazin-1-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 30863248
1-[2-oxo-2-[[4-(pyrrolidin-1-ylmethyl)phenyl]methylamino]ethyl]piperidine-4-carboxylic acid
CID 119907519
N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2-[4-(4-chlorobenzoyl)piperidin-1-yl]acetamide
CID 55988727
N-benzyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
CID 30636341
N-benzyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
CID 63267740

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide?
The IUPAC name of 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide (CID 26037570) is 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide.
What is the SMILES notation for 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide?
The canonical SMILES for 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide is O=C(CN1CCC(C(=O)c2ccccc2)CC1)NCc1ccccc1.
What is the InChIKey of 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide?
The InChIKey is YNMHSICYVPINOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c24-20(22-15-17-7-3-1-4-8-17)16-23-13-11-19(12-14-23)21(25)18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,22,24).
What are the key properties of 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide?
2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide has a molecular weight of 336.44 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide is sourced from PubChem (CID 26037570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).