4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole

C12H12F2N2 — CID 145090352

IUPAC4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole
SMILESCc1c(-c2ccccc2C(F)F)cnn1C
InChIInChI=1S/C12H12F2N2/c1-8-11(7-15-16(8)2)9-5-3-4-6-10(9)12(13)14/h3-7,12H,1-2H3
InChIKeyAZIUMCSIFHKUIF-UHFFFAOYSA-N
MW222.24 g/mol
LogP3.33
Rot. Bonds2

About 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole

4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole (PubChem CID 145090352) has the molecular formula C12H12F2N2 and a molecular weight of 222.24 g/mol. Its IUPAC name is 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole.

Molecular Properties

Compound Name4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole
PubChem CID145090352
Molecular FormulaC12H12F2N2
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole
SMILESCc1c(-c2ccccc2C(F)F)cnn1C
InChIInChI=1S/C12H12F2N2/c1-8-11(7-15-16(8)2)9-5-3-4-6-10(9)12(13)14/h3-7,12H,1-2H3
InChIKeyAZIUMCSIFHKUIF-UHFFFAOYSA-N
XLogP3.33
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole 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

2-(1,5-dimethylpyrazol-4-yl)aniline
CID 66096169
1-methyl-4-(2-propan-2-ylphenyl)pyrazol-5-amine
CID 117307113
1-(difluoromethyl)-2-(4-methylphenyl)benzene
CID 154426240
[2-(1,4-dimethylpyrazol-5-yl)phenyl]methanediol
CID 139504537
4-[2-(1,2-dimethoxyethyl)phenyl]-1-methylpyrazol-5-amine
CID 117407761
2-chloro-3-(1,5-dimethylpyrazol-4-yl)benzoic acid
CID 163208344
7-(1,5-dimethylpyrazol-4-yl)thieno[3,2-c]pyridine
CID 168934007
4-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridine
CID 29090661
4-(3-fluoro-4-methylphenyl)-1,5-dimethylpyrazole
CID 121385904
1-(difluoromethyl)-2-(3-methylphenyl)benzene
CID 123429256
1-(2-bromophenyl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine
CID 43751951
2-chloro-3-(1,5-dimethylpyrazol-4-yl)pyrazine
CID 112559067

Frequently Asked Questions

What is the IUPAC name of 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole?
The IUPAC name of 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole (CID 145090352) is 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole.
What is the SMILES notation for 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole?
The canonical SMILES for 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole is Cc1c(-c2ccccc2C(F)F)cnn1C.
What is the InChIKey of 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole?
The InChIKey is AZIUMCSIFHKUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2/c1-8-11(7-15-16(8)2)9-5-3-4-6-10(9)12(13)14/h3-7,12H,1-2H3.
What are the key properties of 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole?
4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole has a molecular weight of 222.24 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(difluoromethyl)phenyl]-1,5-dimethylpyrazole is sourced from PubChem (CID 145090352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).