5-cyano-N-quinolin-3-ylpyridine-2-carboxamide

C16H10N4O — CID 63719125

IUPAC5-cyano-N-quinolin-3-ylpyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)Nc2cnc3ccccc3c2)nc1
InChIInChI=1S/C16H10N4O/c17-8-11-5-6-15(18-9-11)16(21)20-13-7-12-3-1-2-4-14(12)19-10-13/h1-7,9-10H,(H,20,21)
InChIKeyCCHNSQIPFRVFQV-UHFFFAOYSA-N
MW274.28 g/mol
LogP2.75
Rot. Bonds2

About 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide

5-cyano-N-quinolin-3-ylpyridine-2-carboxamide (PubChem CID 63719125) has the molecular formula C16H10N4O and a molecular weight of 274.28 g/mol. Its IUPAC name is 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-quinolin-3-ylpyridine-2-carboxamide
PubChem CID63719125
Molecular FormulaC16H10N4O
Molecular Weight274.28 g/mol
Exact Mass274.09
IUPAC Name5-cyano-N-quinolin-3-ylpyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)Nc2cnc3ccccc3c2)nc1
InChIInChI=1S/C16H10N4O/c17-8-11-5-6-15(18-9-11)16(21)20-13-7-12-3-1-2-4-14(12)19-10-13/h1-7,9-10H,(H,20,21)
InChIKeyCCHNSQIPFRVFQV-UHFFFAOYSA-N
XLogP2.75
TPSA78.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyano-N-(3,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 63716894
N-(3-aminophenyl)-5-cyanopyridine-2-carboxamide
CID 63725037
6-amino-N-quinolin-3-ylpyridine-2-carboxamide
CID 62805980
N-(4-chlorophenyl)-5-cyanopyridine-2-carboxamide
CID 63716705
5-cyano-N-(3-methylsulfanylphenyl)pyridine-2-carboxamide
CID 63719298
3-chloro-N-quinolin-3-ylbenzamide
CID 3284385
3-amino-N-quinolin-3-yl-1H-pyrazole-5-carboxamide
CID 64523845
2-chloro-5-hydroxy-N-quinolin-3-ylbenzamide
CID 106501765
6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
CID 29330391
2-(quinolin-3-ylcarbamoyl)-1,3-thiazole-4-carboxylic acid
CID 116697062
N-(4-carbamoylphenyl)-5-cyanopyridine-2-carboxamide
CID 63718017
4-bromo-N-quinolin-3-ylbenzamide
CID 3301629

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide?
The IUPAC name of 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide (CID 63719125) is 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide?
The canonical SMILES for 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide is N#Cc1ccc(C(=O)Nc2cnc3ccccc3c2)nc1.
What is the InChIKey of 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide?
The InChIKey is CCHNSQIPFRVFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N4O/c17-8-11-5-6-15(18-9-11)16(21)20-13-7-12-3-1-2-4-14(12)19-10-13/h1-7,9-10H,(H,20,21).
What are the key properties of 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide?
5-cyano-N-quinolin-3-ylpyridine-2-carboxamide has a molecular weight of 274.28 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-quinolin-3-ylpyridine-2-carboxamide is sourced from PubChem (CID 63719125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).