N-benzyl-N-phenylquinoline-2-carboxamide

C23H18N2O — CID 2449862

IUPACN-benzyl-N-phenylquinoline-2-carboxamide
SMILESO=C(c1ccc2ccccc2n1)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C23H18N2O/c26-23(22-16-15-19-11-7-8-14-21(19)24-22)25(20-12-5-2-6-13-20)17-18-9-3-1-4-10-18/h1-16H,17H2
InChIKeyVGJPPBAMRDOHLE-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.08
Rot. Bonds4

About N-benzyl-N-phenylquinoline-2-carboxamide

N-benzyl-N-phenylquinoline-2-carboxamide (PubChem CID 2449862) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is N-benzyl-N-phenylquinoline-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-phenylquinoline-2-carboxamide
PubChem CID2449862
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC NameN-benzyl-N-phenylquinoline-2-carboxamide
SMILESO=C(c1ccc2ccccc2n1)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C23H18N2O/c26-23(22-16-15-19-11-7-8-14-21(19)24-22)25(20-12-5-2-6-13-20)17-18-9-3-1-4-10-18/h1-16H,17H2
InChIKeyVGJPPBAMRDOHLE-UHFFFAOYSA-N
XLogP5.08
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-(4-methoxyphenyl)-1,6-naphthyridine-2-carboxamide
CID 167873021
N-benzyl-N-phenyl-1,3-thiazole-4-carboxamide
CID 62044821
N-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)quinoline-2-carboxamide
CID 51121562
N-benzyl-1-methyl-6-oxo-N-phenylpyridazine-3-carboxamide
CID 42161824
N-ethyl-N-methylquinoline-2-carboxamide
CID 19793658
copper;quinoline-2-carboxylic acid
CID 68537473
europium;quinoline-2-carboxylic acid
CID 87730482
N-benzyl-6-oxo-N-phenyl-1H-pyrimidine-4-carboxamide
CID 137147342
N-benzyl-7-chloro-N-(2-hydroxyethyl)quinoline-2-carboxamide
CID 111969900
[2-(N-methylanilino)-2-oxoethyl] quinoline-2-carboxylate
CID 2352915
chromium(3+);tris(quinoline-2-carboxylate)
CID 86616048
potassium;hydride;quinoline-2-carboxylic acid
CID 174828478

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-phenylquinoline-2-carboxamide?
The IUPAC name of N-benzyl-N-phenylquinoline-2-carboxamide (CID 2449862) is N-benzyl-N-phenylquinoline-2-carboxamide.
What is the SMILES notation for N-benzyl-N-phenylquinoline-2-carboxamide?
The canonical SMILES for N-benzyl-N-phenylquinoline-2-carboxamide is O=C(c1ccc2ccccc2n1)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-N-phenylquinoline-2-carboxamide?
The InChIKey is VGJPPBAMRDOHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c26-23(22-16-15-19-11-7-8-14-21(19)24-22)25(20-12-5-2-6-13-20)17-18-9-3-1-4-10-18/h1-16H,17H2.
What are the key properties of N-benzyl-N-phenylquinoline-2-carboxamide?
N-benzyl-N-phenylquinoline-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 5.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-phenylquinoline-2-carboxamide is sourced from PubChem (CID 2449862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).