6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide

C13H12ClN3O — CID 53433276

IUPAC6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide
SMILESCc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NN
InChIInChI=1S/C13H12ClN3O/c1-8-11(13(18)17-15)6-7-12(16-8)9-2-4-10(14)5-3-9/h2-7H,15H2,1H3,(H,17,18)
InChIKeyYYKITLXYMXOKNO-UHFFFAOYSA-N
MW261.71 g/mol
LogP2.31
Rot. Bonds2

About 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide

6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide (PubChem CID 53433276) has the molecular formula C13H12ClN3O and a molecular weight of 261.71 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide.

Molecular Properties

Compound Name6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide
PubChem CID53433276
Molecular FormulaC13H12ClN3O
Molecular Weight261.71 g/mol
Exact Mass261.07
IUPAC Name6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide
SMILESCc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NN
InChIInChI=1S/C13H12ClN3O/c1-8-11(13(18)17-15)6-7-12(16-8)9-2-4-10(14)5-3-9/h2-7H,15H2,1H3,(H,17,18)
InChIKeyYYKITLXYMXOKNO-UHFFFAOYSA-N
XLogP2.31
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.71
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide 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

1-[6-(4-chlorophenyl)-2-methyl-3-pyridinyl]ethanone
CID 11043024
2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide
CID 82453181
1-(4-chlorophenyl)-3-[[6-(4-methoxyphenyl)-2-methylpyridine-3-carbonyl]amino]urea
CID 155526516
N-[(2S)-1-aminopropan-2-yl]-2-methyl-6-phenylpyridine-3-carboxamide
CID 120508416
2-methyl-6-propan-2-ylpyridine-3-carbohydrazide
CID 82452163
ethyl 6-(4-chlorophenyl)-2-ethylpyridine-3-carboxylate
CID 116532919
N-(1-hydroxypropan-2-yl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 78856776
N-(2-amino-1-cyclopropylethyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 119615030
N-(4-amino-3,5-dichlorophenyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 55464176
ethyl 6-(3-chlorophenyl)-2-methylpyridine-3-carboxylate
CID 112561955
N-(2-amino-2-methylpropyl)-2-methyl-6-phenylpyridine-3-carboxamide;dihydrochloride
CID 119627957
ethyl 6-(4-ethoxyphenyl)-2-methylpyridine-3-carboxylate
CID 115917504

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide?
The IUPAC name of 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide (CID 53433276) is 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide.
What is the SMILES notation for 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide?
The canonical SMILES for 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide is Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NN.
What is the InChIKey of 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide?
The InChIKey is YYKITLXYMXOKNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O/c1-8-11(13(18)17-15)6-7-12(16-8)9-2-4-10(14)5-3-9/h2-7H,15H2,1H3,(H,17,18).
What are the key properties of 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide?
6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide has a molecular weight of 261.71 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide is sourced from PubChem (CID 53433276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).