2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine

C10H10ClN3 — CID 170380800

IUPAC2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine
SMILESCc1cnc(-n2cc(Cl)cn2)c(C)c1
InChIInChI=1S/C10H10ClN3/c1-7-3-8(2)10(12-4-7)14-6-9(11)5-13-14/h3-6H,1-2H3
InChIKeyQFEJJBSOAPOHEN-UHFFFAOYSA-N
MW207.66 g/mol
LogP2.54
Rot. Bonds1

About 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine

2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine (PubChem CID 170380800) has the molecular formula C10H10ClN3 and a molecular weight of 207.66 g/mol. Its IUPAC name is 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine.

Molecular Properties

Compound Name2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine
PubChem CID170380800
Molecular FormulaC10H10ClN3
Molecular Weight207.66 g/mol
Exact Mass207.06
IUPAC Name2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine
SMILESCc1cnc(-n2cc(Cl)cn2)c(C)c1
InChIInChI=1S/C10H10ClN3/c1-7-3-8(2)10(12-4-7)14-6-9(11)5-13-14/h3-6H,1-2H3
InChIKeyQFEJJBSOAPOHEN-UHFFFAOYSA-N
XLogP2.54
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.66
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine?
The IUPAC name of 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine (CID 170380800) is 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine.
What is the SMILES notation for 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine?
The canonical SMILES for 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine is Cc1cnc(-n2cc(Cl)cn2)c(C)c1.
What is the InChIKey of 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine?
The InChIKey is QFEJJBSOAPOHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3/c1-7-3-8(2)10(12-4-7)14-6-9(11)5-13-14/h3-6H,1-2H3.
What are the key properties of 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine?
2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine has a molecular weight of 207.66 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloropyrazol-1-yl)-3,5-dimethylpyridine is sourced from PubChem (CID 170380800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).