3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide

C13H10N4O — CID 104740905

IUPAC3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ncccc2N)cc1
InChIInChI=1S/C13H10N4O/c14-8-9-3-5-10(6-4-9)17-13(18)12-11(15)2-1-7-16-12/h1-7H,15H2,(H,17,18)
InChIKeyOHRLWFKBQCOZNM-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.79
Rot. Bonds2

About 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide

3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide (PubChem CID 104740905) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide
PubChem CID104740905
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC Name3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ncccc2N)cc1
InChIInChI=1S/C13H10N4O/c14-8-9-3-5-10(6-4-9)17-13(18)12-11(15)2-1-7-16-12/h1-7H,15H2,(H,17,18)
InChIKeyOHRLWFKBQCOZNM-UHFFFAOYSA-N
XLogP1.79
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[4-(carbamoylamino)phenyl]pyridine-2-carboxamide
CID 104741358
3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 104741943
3-amino-N-cyanopyridine-2-carboxamide
CID 104742532
2-bromo-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 103754024
3-amino-N-[4-(ethylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 104741386
5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 104742707
[3-[(4-cyanophenyl)carbamoyl]pyrazin-2-yl] hydrogen carbonate
CID 69156027
3-amino-N-[4-chloro-3-(methylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 104741490
3-[(3-aminopyridine-2-carbonyl)amino]benzoic acid
CID 104741844
3-amino-N-(1,3-benzodioxol-5-yl)pyridine-2-carboxamide
CID 104740959
N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide
CID 62249045
N-(3-acetamido-4-fluorophenyl)-3-aminopyridine-2-carboxamide
CID 104741465

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide (CID 104740905) is 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide is N#Cc1ccc(NC(=O)c2ncccc2N)cc1.
What is the InChIKey of 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide?
The InChIKey is OHRLWFKBQCOZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c14-8-9-3-5-10(6-4-9)17-13(18)12-11(15)2-1-7-16-12/h1-7H,15H2,(H,17,18).
What are the key properties of 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide?
3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide has a molecular weight of 238.25 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 104740905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).