5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide

C13H13ClN4OS — CID 62235361

IUPAC5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide
SMILESCSc1cccc(NC(=O)c2cnc(NN)c(Cl)c2)c1
InChIInChI=1S/C13H13ClN4OS/c1-20-10-4-2-3-9(6-10)17-13(19)8-5-11(14)12(18-15)16-7-8/h2-7H,15H2,1H3,(H,16,18)(H,17,19)
InChIKeyPPWPVCZMVKBKFB-UHFFFAOYSA-N
MW308.79 g/mol
LogP2.99
Rot. Bonds4

About 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide

5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide (PubChem CID 62235361) has the molecular formula C13H13ClN4OS and a molecular weight of 308.79 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide
PubChem CID62235361
Molecular FormulaC13H13ClN4OS
Molecular Weight308.79 g/mol
Exact Mass308.05
IUPAC Name5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide
SMILESCSc1cccc(NC(=O)c2cnc(NN)c(Cl)c2)c1
InChIInChI=1S/C13H13ClN4OS/c1-20-10-4-2-3-9(6-10)17-13(19)8-5-11(14)12(18-15)16-7-8/h2-7H,15H2,1H3,(H,16,18)(H,17,19)
InChIKeyPPWPVCZMVKBKFB-UHFFFAOYSA-N
XLogP2.99
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.79
LogP ≤ 52.99
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 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-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

5-chloro-6-hydrazinyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide
CID 62243463
4-methylsulfanyl-N-(3-methylsulfanylphenyl)benzamide
CID 9403388
6-bromo-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide
CID 66462280
5-chloro-N-(4-chloro-3-methoxyphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 107623148
3,5-difluoro-4-hydrazinyl-N-(3-methylsulfanylphenyl)benzamide
CID 63186134
5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 107603472
5-bromo-N-(3-methylsulfanylphenyl)pyridine-2-carboxamide
CID 55153069
5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62236975
5-chloro-6-hydrazinyl-N-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 62241771
5-cyano-N-(3-methylsulfanylphenyl)pyridine-2-carboxamide
CID 63719298
5-chloro-N-(4-cyanophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62248864
3-(carbamoylamino)-N-(3-methylsulfanylphenyl)benzamide
CID 9068240

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide (CID 62235361) is 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide is CSc1cccc(NC(=O)c2cnc(NN)c(Cl)c2)c1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide?
The InChIKey is PPWPVCZMVKBKFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4OS/c1-20-10-4-2-3-9(6-10)17-13(19)8-5-11(14)12(18-15)16-7-8/h2-7H,15H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide?
5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide has a molecular weight of 308.79 g/mol, XLogP of 2.99, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62235361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).