N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide

C22H16N4O2 — CID 26636560

IUPACN-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESNC(=O)c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1
InChIInChI=1S/C22H16N4O2/c23-21(27)14-8-10-15(11-9-14)25-22(28)17-13-20(19-7-3-4-12-24-19)26-18-6-2-1-5-16(17)18/h1-13H,(H2,23,27)(H,25,28)
InChIKeyNEFKQTFGLRTJFD-UHFFFAOYSA-N
MW368.40 g/mol
LogP3.65
Rot. Bonds4

About N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide

N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 26636560) has the molecular formula C22H16N4O2 and a molecular weight of 368.40 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID26636560
Molecular FormulaC22H16N4O2
Molecular Weight368.40 g/mol
Exact Mass368.13
IUPAC NameN-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESNC(=O)c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1
InChIInChI=1S/C22H16N4O2/c23-21(27)14-8-10-15(11-9-14)25-22(28)17-13-20(19-7-3-4-12-24-19)26-18-6-2-1-5-16(17)18/h1-13H,(H2,23,27)(H,25,28)
InChIKeyNEFKQTFGLRTJFD-UHFFFAOYSA-N
XLogP3.65
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.40
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[(2-pyridin-2-ylquinoline-4-carbonyl)amino]benzoate
CID 2220860
N-(4-carbamoylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
CID 1222709
N-(4-phenylmethoxyphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 1257102
N-phenyl-2-pyrimidin-4-ylquinoline-4-carboxamide
CID 56946178
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 27649831
N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 4793520
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
N-(2,5-difluorophenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 50798209
N-cyclopropyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 757672
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 30494390
N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 17065215
N-cyclopentyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 4232578

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide (CID 26636560) is N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide is NC(=O)c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1.
What is the InChIKey of N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is NEFKQTFGLRTJFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4O2/c23-21(27)14-8-10-15(11-9-14)25-22(28)17-13-20(19-7-3-4-12-24-19)26-18-6-2-1-5-16(17)18/h1-13H,(H2,23,27)(H,25,28).
What are the key properties of N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide?
N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 368.40 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 26636560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).