N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide

C13H11N5O — CID 62249045

IUPACN-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccnc(NN)c2)cc1
InChIInChI=1S/C13H11N5O/c14-8-9-1-3-11(4-2-9)17-13(19)10-5-6-16-12(7-10)18-15/h1-7H,15H2,(H,16,18)(H,17,19)
InChIKeyWIAQGEATWWECLG-UHFFFAOYSA-N
MW253.27 g/mol
LogP1.49
Rot. Bonds3

About N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide

N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide (PubChem CID 62249045) has the molecular formula C13H11N5O and a molecular weight of 253.27 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide
PubChem CID62249045
Molecular FormulaC13H11N5O
Molecular Weight253.27 g/mol
Exact Mass253.10
IUPAC NameN-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccnc(NN)c2)cc1
InChIInChI=1S/C13H11N5O/c14-8-9-1-3-11(4-2-9)17-13(19)10-5-6-16-12(7-10)18-15/h1-7H,15H2,(H,16,18)(H,17,19)
InChIKeyWIAQGEATWWECLG-UHFFFAOYSA-N
XLogP1.49
TPSA103.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide (CID 62249045) is N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide is N#Cc1ccc(NC(=O)c2ccnc(NN)c2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide?
The InChIKey is WIAQGEATWWECLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O/c14-8-9-1-3-11(4-2-9)17-13(19)10-5-6-16-12(7-10)18-15/h1-7H,15H2,(H,16,18)(H,17,19).
What are the key properties of N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide?
N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide has a molecular weight of 253.27 g/mol, XLogP of 1.49, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 62249045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).