4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine

C10H9F3N4 — CID 90328443

IUPAC4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine
SMILESCc1cc(C)n(-c2ccnc(C(F)(F)F)n2)n1
InChIInChI=1S/C10H9F3N4/c1-6-5-7(2)17(16-6)8-3-4-14-9(15-8)10(11,12)13/h3-5H,1-2H3
InChIKeyWXVXIZPGIIRRHD-UHFFFAOYSA-N
MW242.20 g/mol
LogP2.30
Rot. Bonds1

About 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine

4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine (PubChem CID 90328443) has the molecular formula C10H9F3N4 and a molecular weight of 242.20 g/mol. Its IUPAC name is 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine.

Molecular Properties

Compound Name4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine
PubChem CID90328443
Molecular FormulaC10H9F3N4
Molecular Weight242.20 g/mol
Exact Mass242.08
IUPAC Name4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine
SMILESCc1cc(C)n(-c2ccnc(C(F)(F)F)n2)n1
InChIInChI=1S/C10H9F3N4/c1-6-5-7(2)17(16-6)8-3-4-14-9(15-8)10(11,12)13/h3-5H,1-2H3
InChIKeyWXVXIZPGIIRRHD-UHFFFAOYSA-N
XLogP2.30
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine 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

Pyrazolo(1,5-a)pyrimidine, 5,7-dimethyl-
CID 215186
3-Bromo-5,7-dimethylpyrazolo(1,5-a)pyrimidine
CID 198235
Pyrazolo(1.5-a)pyrimidine, 5,7-dimethyl-3-iodo-
CID 206164
5-Methylpyrazolo[1,5-a]pyrimidine
CID 12581392
2-Methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 1480446
4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-2-amine
CID 742814
4,6-Bis(3,5-dimethyl-1H-pyrazole-1-yl)pyrimidine
CID 762995
2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-pyrimidinecarbonitrile
CID 2766549
2-(3,5-dimethylpyrazol-1-yl)-6-pyrazol-1-yl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 72945318
3,5,7-Trimethylpyrazolo[1,5-a]pyrimidine
CID 18684975
5,7-Dimethyl 3-fluoro pyrazolo[1,5-a]pyrimidine
CID 20324958
5-Methyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 671687

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine?
The IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine (CID 90328443) is 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine.
What is the SMILES notation for 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine?
The canonical SMILES for 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine is Cc1cc(C)n(-c2ccnc(C(F)(F)F)n2)n1.
What is the InChIKey of 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine?
The InChIKey is WXVXIZPGIIRRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4/c1-6-5-7(2)17(16-6)8-3-4-14-9(15-8)10(11,12)13/h3-5H,1-2H3.
What are the key properties of 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine?
4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine has a molecular weight of 242.20 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)pyrimidine is sourced from PubChem (CID 90328443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).