N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide

C14H11N3O2 — CID 62103587

IUPACN-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide
SMILESCc1ccc(C#N)cc1NC(=O)c1ncccc1O
InChIInChI=1S/C14H11N3O2/c1-9-4-5-10(8-15)7-11(9)17-14(19)13-12(18)3-2-6-16-13/h2-7,18H,1H3,(H,17,19)
InChIKeyGEPQVVYFCMGINI-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.22
Rot. Bonds2

About N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide

N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide (PubChem CID 62103587) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide
PubChem CID62103587
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC NameN-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide
SMILESCc1ccc(C#N)cc1NC(=O)c1ncccc1O
InChIInChI=1S/C14H11N3O2/c1-9-4-5-10(8-15)7-11(9)17-14(19)13-12(18)3-2-6-16-13/h2-7,18H,1H3,(H,17,19)
InChIKeyGEPQVVYFCMGINI-UHFFFAOYSA-N
XLogP2.22
TPSA86.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-cyano-2-methylphenyl)-2-methoxypyridine-3-carboxamide
CID 62060853
N-[5-[(dimethylamino)methyl]-2-methylphenyl]-3-hydroxypyridine-2-carboxamide
CID 167841465
N-(5-cyano-2-methylphenyl)-2,5-dihydroxybenzamide
CID 107721998
6-bromo-N-(5-cyano-2-methylphenyl)pyridine-3-carboxamide
CID 66464924
N-(2,5-difluoro-4-methylphenyl)-3-hydroxypyridine-2-carboxamide
CID 103586322
2,6-dichloro-N-(5-cyano-2-methylphenyl)benzamide
CID 62105070
N-(5-cyano-2-methylphenyl)-2,3-dimethylbenzamide
CID 47475875
N-(5-cyano-2-methylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 47475999
N-(5-cyano-2-methylphenyl)-2-fluorobenzamide
CID 47475835
6-chloro-N-(5-cyano-2-methylphenyl)pyridine-3-carboxamide
CID 47475855
N-(5-cyano-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385118
N-(2,5-dimethylphenyl)-3-fluoropyridine-2-carboxamide
CID 110474800

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide (CID 62103587) is N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide is Cc1ccc(C#N)cc1NC(=O)c1ncccc1O.
What is the InChIKey of N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide?
The InChIKey is GEPQVVYFCMGINI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c1-9-4-5-10(8-15)7-11(9)17-14(19)13-12(18)3-2-6-16-13/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide?
N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide has a molecular weight of 253.26 g/mol, XLogP of 2.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-2-methylphenyl)-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 62103587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).