N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide

C13H10ClN5O — CID 107810316

IUPACN-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccncc2NN)c(Cl)c1
InChIInChI=1S/C13H10ClN5O/c14-10-5-8(6-15)1-2-11(10)18-13(20)9-3-4-17-7-12(9)19-16/h1-5,7,19H,16H2,(H,18,20)
InChIKeyCZMIJSUCBUUOPO-UHFFFAOYSA-N
MW287.71 g/mol
LogP2.14
Rot. Bonds3

About N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide

N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide (PubChem CID 107810316) has the molecular formula C13H10ClN5O and a molecular weight of 287.71 g/mol. Its IUPAC name is N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide
PubChem CID107810316
Molecular FormulaC13H10ClN5O
Molecular Weight287.71 g/mol
Exact Mass287.06
IUPAC NameN-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccncc2NN)c(Cl)c1
InChIInChI=1S/C13H10ClN5O/c14-10-5-8(6-15)1-2-11(10)18-13(20)9-3-4-17-7-12(9)19-16/h1-5,7,19H,16H2,(H,18,20)
InChIKeyCZMIJSUCBUUOPO-UHFFFAOYSA-N
XLogP2.14
TPSA103.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.71
LogP ≤ 52.14
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-(2-chloro-4-cyanophenyl)-3-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

Related Compounds

N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 107606116
N-(2-cyano-4-fluorophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 105072391
N-(2-chloro-4-cyanophenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 107808178
2,5-dichloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 103799731
N-(2-chloro-4-cyanophenyl)-5-hydroxypyridine-3-carboxamide
CID 107808799
4-amino-N-(2-chloro-4-cyanophenyl)pyridine-2-carboxamide
CID 107810218
2-amino-4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 107806873
5-chloro-N-(2-chloro-4-cyanophenyl)pyridine-2-carboxamide
CID 103811024
N-(2-cyano-3-fluorophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 105071575
N-(4-cyano-2-fluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105070875
N-(2-chloro-4-cyanophenyl)-2-methylbenzamide
CID 103799806
6-amino-N-(2-chloro-4-cyanophenyl)pyridine-3-carboxamide
CID 107810194

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide (CID 107810316) is N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide is N#Cc1ccc(NC(=O)c2ccncc2NN)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is CZMIJSUCBUUOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN5O/c14-10-5-8(6-15)1-2-11(10)18-13(20)9-3-4-17-7-12(9)19-16/h1-5,7,19H,16H2,(H,18,20).
What are the key properties of N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide?
N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide has a molecular weight of 287.71 g/mol, XLogP of 2.14, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 107810316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).