N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide

C20H22N2O2 — CID 2937708

IUPACN-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide
SMILESCC1CCCCN1C(=O)c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C20H22N2O2/c1-15-8-5-6-13-22(15)20(24)17-11-7-12-18(14-17)21-19(23)16-9-3-2-4-10-16/h2-4,7,9-12,14-15H,5-6,8,13H2,1H3,(H,21,23)
InChIKeyRIJIFVSKKHVDAJ-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.95
Rot. Bonds3

About N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide

N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide (PubChem CID 2937708) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide
PubChem CID2937708
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide
SMILESCC1CCCCN1C(=O)c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C20H22N2O2/c1-15-8-5-6-13-22(15)20(24)17-11-7-12-18(14-17)21-19(23)16-9-3-2-4-10-16/h2-4,7,9-12,14-15H,5-6,8,13H2,1H3,(H,21,23)
InChIKeyRIJIFVSKKHVDAJ-UHFFFAOYSA-N
XLogP3.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[3-(2-methylpiperidine-1-carbonyl)phenyl]carbamate
CID 24537551
[3-(methylamino)phenyl]-(2-methylpyrrolidin-1-yl)methanone
CID 83625399
(3-bromophenyl)-[(2S)-2-methylpiperidin-1-yl]methanone
CID 40543984
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CID 4019473
3-amino-N-[4-(2-methylpiperidine-1-carbonyl)phenyl]benzamide;hydrochloride
CID 119712991
N-[3-[(2R)-2-methylpiperidine-1-carbonyl]-5-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-2,2-diphenylacetamide
CID 27892566
(2R,3R)-1-[3-[(4-fluorobenzoyl)amino]benzoyl]-2-methylpiperidine-3-carboxylic acid
CID 122115413
1-[3-[(2-methylbenzoyl)amino]benzoyl]piperidine-2-carboxylic acid
CID 132900807
[4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-phenylmethanone
CID 2532732
N-(3-acetylphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056486
(3-aminophenyl)-(2-methylpiperidin-1-yl)methanone;hydrochloride
CID 119676366
methyl 1-(3-benzamidobenzoyl)piperidine-4-carboxylate
CID 3585170

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide?
The IUPAC name of N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide (CID 2937708) is N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide is CC1CCCCN1C(=O)c1cccc(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide?
The InChIKey is RIJIFVSKKHVDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-15-8-5-6-13-22(15)20(24)17-11-7-12-18(14-17)21-19(23)16-9-3-2-4-10-16/h2-4,7,9-12,14-15H,5-6,8,13H2,1H3,(H,21,23).
What are the key properties of N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide?
N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide has a molecular weight of 322.41 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylpiperidine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 2937708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).