2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine

C9H6Cl3N3 — CID 102752171

IUPAC2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine
SMILESCc1ccn(-c2nc(Cl)c(Cl)cc2Cl)n1
InChIInChI=1S/C9H6Cl3N3/c1-5-2-3-15(14-5)9-7(11)4-6(10)8(12)13-9/h2-4H,1H3
InChIKeyRDVSZROAIHLZIV-UHFFFAOYSA-N
MW262.53 g/mol
LogP3.54
Rot. Bonds1

About 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine

2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine (PubChem CID 102752171) has the molecular formula C9H6Cl3N3 and a molecular weight of 262.53 g/mol. Its IUPAC name is 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine
PubChem CID102752171
Molecular FormulaC9H6Cl3N3
Molecular Weight262.53 g/mol
Exact Mass260.96
IUPAC Name2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine
SMILESCc1ccn(-c2nc(Cl)c(Cl)cc2Cl)n1
InChIInChI=1S/C9H6Cl3N3/c1-5-2-3-15(14-5)9-7(11)4-6(10)8(12)13-9/h2-4H,1H3
InChIKeyRDVSZROAIHLZIV-UHFFFAOYSA-N
XLogP3.54
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.53
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine 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

3,5-dichloro-6-(3-methylpyrazol-1-yl)-N-propylpyridin-2-amine
CID 102760287
5-chloro-4-(3-methylpyrazol-1-yl)pyrimidine-2-carbaldehyde
CID 156842756
5-chloro-4-(3-methylpyrazol-1-yl)pyrimidine-2-carboxylic acid
CID 156842556
4-chloro-6-(3-methylpyrazol-1-yl)pyrimidin-5-amine
CID 63021721
3,5-dichloro-4-(3-methylpyrazol-1-yl)aniline
CID 106890917
5-bromo-2-chloro-4-(3-methylpyrazol-1-yl)pyrimidine
CID 79073131
3-(chloromethyl)-4,6-dimethyl-2-(3-methylpyrazol-1-yl)pyridine
CID 62490039
2,3,5-trichloro-6-imidazol-1-ylpyridine
CID 102752140
5-chloro-6-(2-chloro-4-fluorophenyl)-1-(2-methylbutyl)-3-(3-methylpyrazol-1-yl)pyrazin-2-one
CID 57432932
1-[3-chloro-4-(3-methylpyrazol-1-yl)phenyl]ethanone
CID 62907633
2-chloro-4-(3-methylpyrazol-1-yl)benzoyl chloride
CID 22605446
1-[2,4-dimethyl-5-(3-methylpyrazol-1-yl)benzene-6-id-1-yl]-3-methylpyrazole
CID 102401866

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine?
The IUPAC name of 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine (CID 102752171) is 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine.
What is the SMILES notation for 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine?
The canonical SMILES for 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine is Cc1ccn(-c2nc(Cl)c(Cl)cc2Cl)n1.
What is the InChIKey of 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine?
The InChIKey is RDVSZROAIHLZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6Cl3N3/c1-5-2-3-15(14-5)9-7(11)4-6(10)8(12)13-9/h2-4H,1H3.
What are the key properties of 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine?
2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine has a molecular weight of 262.53 g/mol, XLogP of 3.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trichloro-6-(3-methylpyrazol-1-yl)pyridine is sourced from PubChem (CID 102752171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).