4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide

C20H16N2O2 — CID 51051173

IUPAC4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide
SMILESCN(C(=O)c1ccc(C(=O)c2ccccc2)cc1)c1ccccn1
InChIInChI=1S/C20H16N2O2/c1-22(18-9-5-6-14-21-18)20(24)17-12-10-16(11-13-17)19(23)15-7-3-2-4-8-15/h2-14H,1H3
InChIKeyHBTDPHGLESOBFR-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.59
Rot. Bonds4

About 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide

4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide (PubChem CID 51051173) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide
PubChem CID51051173
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide
SMILESCN(C(=O)c1ccc(C(=O)c2ccccc2)cc1)c1ccccn1
InChIInChI=1S/C20H16N2O2/c1-22(18-9-5-6-14-21-18)20(24)17-12-10-16(11-13-17)19(23)15-7-3-2-4-8-15/h2-14H,1H3
InChIKeyHBTDPHGLESOBFR-UHFFFAOYSA-N
XLogP3.59
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-phenyl-N-pyridin-2-ylbenzamide
CID 51051172
3-[4-[methyl(pyridin-2-yl)carbamoyl]phenyl]prop-2-enoic acid
CID 54128351
6-amino-N-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 62153613
2-N,6-N-dimethyl-2-N,6-N-dipyridin-2-ylpyridine-2,6-dicarboxamide
CID 101347293
4-benzoyl-N,N-dimethylbenzamide
CID 12779824
N'-tert-butyl-N'-methyl-N-pyridin-2-ylbenzohydrazide
CID 19368177
2-[methyl(pyridin-2-yl)carbamoyl]pyridine-3-carboxylic acid
CID 63616222
N-methyl-N-pyridin-2-yl-1-benzofuran-5-carboxamide
CID 141014022
N-methyl-2-oxo-N-pyridin-2-yl-1H-pyridine-4-carboxamide
CID 113258009
3,5-ditert-butyl-4-hydroxy-N-methyl-N-pyridin-2-ylbenzamide
CID 87590949
N-[6-[6-[benzoyl(methyl)amino]-2-pyridinyl]-2-pyridinyl]-N-methylbenzamide
CID 101359093
5-carbamothioyl-N-methyl-N-pyridin-2-ylpyridine-2-carboxamide
CID 63723408

Frequently Asked Questions

What is the IUPAC name of 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide?
The IUPAC name of 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide (CID 51051173) is 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide?
The canonical SMILES for 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide is CN(C(=O)c1ccc(C(=O)c2ccccc2)cc1)c1ccccn1.
What is the InChIKey of 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide?
The InChIKey is HBTDPHGLESOBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c1-22(18-9-5-6-14-21-18)20(24)17-12-10-16(11-13-17)19(23)15-7-3-2-4-8-15/h2-14H,1H3.
What are the key properties of 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide?
4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide has a molecular weight of 316.36 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzoyl-N-methyl-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 51051173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).