5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide

C14H12N4O — CID 54913836

IUPAC5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C14H12N4O/c1-9-12(6-11(16)8-17-9)14(19)18-13-5-3-2-4-10(13)7-15/h2-6,8H,16H2,1H3,(H,18,19)
InChIKeyCUXXEBLVJUTQKN-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.10
Rot. Bonds2

About 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide

5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide (PubChem CID 54913836) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide
PubChem CID54913836
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C14H12N4O/c1-9-12(6-11(16)8-17-9)14(19)18-13-5-3-2-4-10(13)7-15/h2-6,8H,16H2,1H3,(H,18,19)
InChIKeyCUXXEBLVJUTQKN-UHFFFAOYSA-N
XLogP2.10
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-methyl-N-(2-methylsulfanylphenyl)pyridine-3-carboxamide
CID 61117272
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CID 61039486
5-amino-2-methyl-N-(2-methylsulfonylphenyl)pyridine-3-carboxamide
CID 61112376
5-amino-N-(3-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
CID 54917147
N-(2-cyanophenyl)-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 110864734
4-amino-N-(2-cyanophenyl)pyridine-3-carboxamide
CID 81235852
5-amino-N-(2,5-dibromophenyl)-2-methylpyridine-3-carboxamide
CID 61466356
5-amino-N-(2-fluoro-5-methylphenyl)-2-methylpyridine-3-carboxamide
CID 54916911
2-bromo-N-(2-cyanophenyl)-3-methylbenzamide
CID 103857096
5-amino-N-(4-chloro-2-fluorophenyl)-2-methylpyridine-3-carboxamide
CID 61111163
N-(2-cyanophenyl)-2-methyl-1,3-thiazole-5-carboxamide
CID 110864602
5-amino-2-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 54917395

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide?
The IUPAC name of 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide (CID 54913836) is 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide?
The canonical SMILES for 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)Nc1ccccc1C#N.
What is the InChIKey of 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide?
The InChIKey is CUXXEBLVJUTQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-9-12(6-11(16)8-17-9)14(19)18-13-5-3-2-4-10(13)7-15/h2-6,8H,16H2,1H3,(H,18,19).
What are the key properties of 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide?
5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide has a molecular weight of 252.28 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-cyanophenyl)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 54913836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).