N-(2-cyanophenyl)quinoline-2-carboxamide

C17H11N3O — CID 10588311

IUPACN-(2-cyanophenyl)quinoline-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C17H11N3O/c18-11-13-6-2-4-8-15(13)20-17(21)16-10-9-12-5-1-3-7-14(12)19-16/h1-10H,(H,20,21)
InChIKeyJHMZWNKKWFMSHW-UHFFFAOYSA-N
MW273.30 g/mol
LogP3.36
Rot. Bonds2

About N-(2-cyanophenyl)quinoline-2-carboxamide

N-(2-cyanophenyl)quinoline-2-carboxamide (PubChem CID 10588311) has the molecular formula C17H11N3O and a molecular weight of 273.30 g/mol. Its IUPAC name is N-(2-cyanophenyl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)quinoline-2-carboxamide
PubChem CID10588311
Molecular FormulaC17H11N3O
Molecular Weight273.30 g/mol
Exact Mass273.09
IUPAC NameN-(2-cyanophenyl)quinoline-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C17H11N3O/c18-11-13-6-2-4-8-15(13)20-17(21)16-10-9-12-5-1-3-7-14(12)19-16/h1-10H,(H,20,21)
InChIKeyJHMZWNKKWFMSHW-UHFFFAOYSA-N
XLogP3.36
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)quinoline-2-carboxamide
CID 878226
6-bromo-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 103889509
N-[2-(hydroxymethyl)phenyl]quinoline-2-carboxamide
CID 60653534
N-(2-cyanophenyl)-1,3-thiazole-4-carboxamide
CID 63024235
N-[2-[(2,2-difluoroacetyl)amino]phenyl]quinoline-2-carboxamide
CID 119050195
N-[2-(trifluoromethyl)phenyl]quinoline-2-carboxamide
CID 127043003
6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
CID 55043296
N-(3-hydroxy-2-methylphenyl)quinoline-2-carboxamide
CID 64794719
8-(quinoline-2-carbonylamino)quinoline-2-carboxylic acid
CID 118902335
N-(2-cyanophenyl)thiadiazole-4-carboxamide
CID 65214777
2-N-(4-acetylphenyl)-6-N-(2-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109101022
N-(2-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62239776

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)quinoline-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)quinoline-2-carboxamide (CID 10588311) is N-(2-cyanophenyl)quinoline-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)quinoline-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)quinoline-2-carboxamide is N#Cc1ccccc1NC(=O)c1ccc2ccccc2n1.
What is the InChIKey of N-(2-cyanophenyl)quinoline-2-carboxamide?
The InChIKey is JHMZWNKKWFMSHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O/c18-11-13-6-2-4-8-15(13)20-17(21)16-10-9-12-5-1-3-7-14(12)19-16/h1-10H,(H,20,21).
What are the key properties of N-(2-cyanophenyl)quinoline-2-carboxamide?
N-(2-cyanophenyl)quinoline-2-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)quinoline-2-carboxamide is sourced from PubChem (CID 10588311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).