N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide

C15H14N4O — CID 110299301

IUPACN-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C15H14N4O/c1-19(2)14-12(7-5-9-17-14)15(20)18-13-8-4-3-6-11(13)10-16/h3-9H,1-2H3,(H,18,20)
InChIKeyNTOGGKLEDUPCHL-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.27
Rot. Bonds3

About N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide

N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide (PubChem CID 110299301) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide
PubChem CID110299301
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C15H14N4O/c1-19(2)14-12(7-5-9-17-14)15(20)18-13-8-4-3-6-11(13)10-16/h3-9H,1-2H3,(H,18,20)
InChIKeyNTOGGKLEDUPCHL-UHFFFAOYSA-N
XLogP2.27
TPSA69.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(dimethylamino)-N-phenylpyridine-3-carboxamide
CID 38885522
2-(dimethylamino)-N-(2,3-dimethylphenyl)pyridine-3-carboxamide
CID 38885784
2-(dimethylamino)-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 110475171
2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 110299292
N-(2-cyanophenyl)-2-(propan-2-ylamino)benzamide
CID 63107973
1-N-(2-cyanophenyl)-4-N-quinolin-8-ylbenzene-1,4-dicarboxamide
CID 109050221
N-(2-cyanophenyl)-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 110864734
N-(3,5-dichlorophenyl)-2-(dimethylamino)pyridine-3-carboxamide
CID 38887368
2-bromo-N-(2-cyanophenyl)-3-methylbenzamide
CID 103857096
2-(dimethylamino)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 110299276
N-(2-cyanophenyl)-2-propoxybenzamide
CID 4947824
N-(2-cyanophenyl)-2-(trifluoromethyl)benzamide
CID 24695576

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide (CID 110299301) is N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide is CN(C)c1ncccc1C(=O)Nc1ccccc1C#N.
What is the InChIKey of N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide?
The InChIKey is NTOGGKLEDUPCHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-19(2)14-12(7-5-9-17-14)15(20)18-13-8-4-3-6-11(13)10-16/h3-9H,1-2H3,(H,18,20).
What are the key properties of N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide?
N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-(dimethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 110299301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).