2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine

C11H9ClF3N3 — CID 66021406

IUPAC2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine
SMILESCc1ccnc(-n2nc(C(F)(F)F)c(C)c2Cl)c1
InChIInChI=1S/C11H9ClF3N3/c1-6-3-4-16-8(5-6)18-10(12)7(2)9(17-18)11(13,14)15/h3-5H,1-2H3
InChIKeyZPYIJYVMYAZAGB-UHFFFAOYSA-N
MW275.66 g/mol
LogP3.56
Rot. Bonds1

About 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine

2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine (PubChem CID 66021406) has the molecular formula C11H9ClF3N3 and a molecular weight of 275.66 g/mol. Its IUPAC name is 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine.

Molecular Properties

Compound Name2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine
PubChem CID66021406
Molecular FormulaC11H9ClF3N3
Molecular Weight275.66 g/mol
Exact Mass275.04
IUPAC Name2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine
SMILESCc1ccnc(-n2nc(C(F)(F)F)c(C)c2Cl)c1
InChIInChI=1S/C11H9ClF3N3/c1-6-3-4-16-8(5-6)18-10(12)7(2)9(17-18)11(13,14)15/h3-5H,1-2H3
InChIKeyZPYIJYVMYAZAGB-UHFFFAOYSA-N
XLogP3.56
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.66
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine 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

7-(4-Chlorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 735871
3-Chloro-7-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 3631022
2-(3,5-dimethyl-1H-pyrazol-1-yl)pyridine
CID 676764
R3871-N35
CID 44408653
6-(3-Chloro-5-(trifluoromethyl)-2-pyridinyl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 1478913
3,5-dichloro-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridin-2-amine
CID 2405784
1-methyl-5-[4-(2-pyridinyl)piperazino]-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile
CID 3833549
(E)-1-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-N-(4-pyridin-2-ylpiperazin-1-yl)methanimine
CID 6901075
5-chloro-2-(1H-pyrazol-1-yl)pyridine
CID 63811476
4-Chloro-2-(pyridin-4-yl)-6-(trifluoromethyl)pyrimidine
CID 1485989
3-chloro-5-methyl-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 3820364
3,5-dichloro-N-[5-methyl-2-(2-methylphenyl)pyrazol-3-yl]pyridin-2-amine
CID 4242520

Frequently Asked Questions

What is the IUPAC name of 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine?
The IUPAC name of 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine (CID 66021406) is 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine.
What is the SMILES notation for 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine?
The canonical SMILES for 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine is Cc1ccnc(-n2nc(C(F)(F)F)c(C)c2Cl)c1.
What is the InChIKey of 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine?
The InChIKey is ZPYIJYVMYAZAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClF3N3/c1-6-3-4-16-8(5-6)18-10(12)7(2)9(17-18)11(13,14)15/h3-5H,1-2H3.
What are the key properties of 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine?
2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine has a molecular weight of 275.66 g/mol, XLogP of 3.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-chloro-4-methyl-3-(trifluoromethyl)pyrazol-1-yl]-4-methylpyridine is sourced from PubChem (CID 66021406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).