N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide

C23H18N2O2 — CID 110324311

IUPACN-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide
SMILESO=C(NCc1cc2ccccc2[nH]c1=O)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C23H18N2O2/c26-22(19-11-6-10-17(13-19)16-7-2-1-3-8-16)24-15-20-14-18-9-4-5-12-21(18)25-23(20)27/h1-14H,15H2,(H,24,26)(H,25,27)
InChIKeyREUPAUSAZQPJMS-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.13
Rot. Bonds4

About N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide

N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide (PubChem CID 110324311) has the molecular formula C23H18N2O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide.

Molecular Properties

Compound NameN-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide
PubChem CID110324311
Molecular FormulaC23H18N2O2
Molecular Weight354.41 g/mol
Exact Mass354.14
IUPAC NameN-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide
SMILESO=C(NCc1cc2ccccc2[nH]c1=O)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C23H18N2O2/c26-22(19-11-6-10-17(13-19)16-7-2-1-3-8-16)24-15-20-14-18-9-4-5-12-21(18)25-23(20)27/h1-14H,15H2,(H,24,26)(H,25,27)
InChIKeyREUPAUSAZQPJMS-UHFFFAOYSA-N
XLogP4.13
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]-4-phenylbenzamide
CID 110325649
N-[(2-oxo-1H-quinolin-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
CID 110324306
N-[(2-oxo-1H-quinolin-3-yl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 110619586
N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 110619588
6-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1H-pyridazine-3-carboxamide
CID 110662606
N-[(2-oxo-1H-quinolin-3-yl)methyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 110608823
5-(3-methoxyphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1,2-oxazole-3-carboxamide
CID 110619594
N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-(4-phenyl-1,3-thiazol-2-yl)propanamide
CID 110608858
N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-3-phenylbenzamide
CID 110730367
N-[(2-oxo-1H-quinolin-3-yl)methyl]-4-([1,2,4]triazolo[4,3-a]pyrimidin-3-yl)benzamide
CID 110413329
(2S)-4-methyl-2-[(2-oxo-1H-quinolin-3-yl)methylamino]pentanoic acid
CID 120510789
methyl 3-[(2-oxo-1H-quinolin-3-yl)methylamino]benzoate
CID 75403102

Frequently Asked Questions

What is the IUPAC name of N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide?
The IUPAC name of N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide (CID 110324311) is N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide.
What is the SMILES notation for N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide?
The canonical SMILES for N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide is O=C(NCc1cc2ccccc2[nH]c1=O)c1cccc(-c2ccccc2)c1.
What is the InChIKey of N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide?
The InChIKey is REUPAUSAZQPJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O2/c26-22(19-11-6-10-17(13-19)16-7-2-1-3-8-16)24-15-20-14-18-9-4-5-12-21(18)25-23(20)27/h1-14H,15H2,(H,24,26)(H,25,27).
What are the key properties of N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide?
N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide has a molecular weight of 354.41 g/mol, XLogP of 4.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide is sourced from PubChem (CID 110324311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).