3-(5-chloro-4-methylpyrazol-1-yl)pyridine

C9H8ClN3 — CID 19757098

IUPAC3-(5-chloro-4-methylpyrazol-1-yl)pyridine
SMILESCc1cnn(-c2cccnc2)c1Cl
InChIInChI=1S/C9H8ClN3/c1-7-5-12-13(9(7)10)8-3-2-4-11-6-8/h2-6H,1H3
InChIKeyOLTQZIOQZUKHDT-UHFFFAOYSA-N
MW193.64 g/mol
LogP2.23
Rot. Bonds1

About 3-(5-chloro-4-methylpyrazol-1-yl)pyridine

3-(5-chloro-4-methylpyrazol-1-yl)pyridine (PubChem CID 19757098) has the molecular formula C9H8ClN3 and a molecular weight of 193.64 g/mol. Its IUPAC name is 3-(5-chloro-4-methylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name3-(5-chloro-4-methylpyrazol-1-yl)pyridine
PubChem CID19757098
Molecular FormulaC9H8ClN3
Molecular Weight193.64 g/mol
Exact Mass193.04
IUPAC Name3-(5-chloro-4-methylpyrazol-1-yl)pyridine
SMILESCc1cnn(-c2cccnc2)c1Cl
InChIInChI=1S/C9H8ClN3/c1-7-5-12-13(9(7)10)8-3-2-4-11-6-8/h2-6H,1H3
InChIKeyOLTQZIOQZUKHDT-UHFFFAOYSA-N
XLogP2.23
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.64
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chloro-1-pyridin-3-ylpyrazol-4-yl)carbamic acid
CID 67499904
5-chloro-1-(4-chlorophenyl)-4-methylpyrazole
CID 20686663
3-(5-chloro-4-phenylmethoxypyrazol-1-yl)pyridine
CID 117232501
3-(4-chloro-1-pyridin-3-ylpyrazol-5-yl)pyridine
CID 174760347
4,5-dichloro-2-pyridin-3-ylpyridazin-3-one
CID 130501966
3-[5-(4-chlorophenyl)tetrazol-1-yl]pyridine
CID 2799832
3-chloro-2-pyridin-3-ylindazole
CID 134094821
3-[4,5-di(propan-2-yl)pyrazol-1-yl]pyridine
CID 58128806
5-chloro-2-(2-pyridin-3-ylpyrazol-3-yl)pyridine
CID 141118064
5-(methylamino)-1-pyridin-3-ylpyrazole-4-carbonitrile
CID 164945769
1-pyridin-3-yl-5-(trifluoromethyl)pyrazol-4-amine
CID 169213571
N-(4-methyl-1-phenylpyrazol-5-yl)pyridine-3-carboxamide
CID 99818669

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-4-methylpyrazol-1-yl)pyridine?
The IUPAC name of 3-(5-chloro-4-methylpyrazol-1-yl)pyridine (CID 19757098) is 3-(5-chloro-4-methylpyrazol-1-yl)pyridine.
What is the SMILES notation for 3-(5-chloro-4-methylpyrazol-1-yl)pyridine?
The canonical SMILES for 3-(5-chloro-4-methylpyrazol-1-yl)pyridine is Cc1cnn(-c2cccnc2)c1Cl.
What is the InChIKey of 3-(5-chloro-4-methylpyrazol-1-yl)pyridine?
The InChIKey is OLTQZIOQZUKHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3/c1-7-5-12-13(9(7)10)8-3-2-4-11-6-8/h2-6H,1H3.
What are the key properties of 3-(5-chloro-4-methylpyrazol-1-yl)pyridine?
3-(5-chloro-4-methylpyrazol-1-yl)pyridine has a molecular weight of 193.64 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-4-methylpyrazol-1-yl)pyridine is sourced from PubChem (CID 19757098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).