5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine

C11H12ClN3 — CID 66233907

IUPAC5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine
SMILESCc1nn(-c2ccc(Cl)cn2)c(C)c1C
InChIInChI=1S/C11H12ClN3/c1-7-8(2)14-15(9(7)3)11-5-4-10(12)6-13-11/h4-6H,1-3H3
InChIKeyFWFGULVGCYIERD-UHFFFAOYSA-N
MW221.69 g/mol
LogP2.85
Rot. Bonds1

About 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine

5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine (PubChem CID 66233907) has the molecular formula C11H12ClN3 and a molecular weight of 221.69 g/mol. Its IUPAC name is 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine
PubChem CID66233907
Molecular FormulaC11H12ClN3
Molecular Weight221.69 g/mol
Exact Mass221.07
IUPAC Name5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine
SMILESCc1nn(-c2ccc(Cl)cn2)c(C)c1C
InChIInChI=1S/C11H12ClN3/c1-7-8(2)14-15(9(7)3)11-5-4-10(12)6-13-11/h4-6H,1-3H3
InChIKeyFWFGULVGCYIERD-UHFFFAOYSA-N
XLogP2.85
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.69
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-chloro-2-(3,4,5-trimethylpyrazol-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

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine?
The IUPAC name of 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine (CID 66233907) is 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine.
What is the SMILES notation for 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine?
The canonical SMILES for 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine is Cc1nn(-c2ccc(Cl)cn2)c(C)c1C.
What is the InChIKey of 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine?
The InChIKey is FWFGULVGCYIERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3/c1-7-8(2)14-15(9(7)3)11-5-4-10(12)6-13-11/h4-6H,1-3H3.
What are the key properties of 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine?
5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine has a molecular weight of 221.69 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(3,4,5-trimethylpyrazol-1-yl)pyridine is sourced from PubChem (CID 66233907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).