7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine

C10H8ClF5N2 — CID 134468902

IUPAC7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine
SMILESCC1=CC(C(F)F)=C(Cl)N2NC(C(F)(F)F)C=C12
InChIInChI=1S/C10H8ClF5N2/c1-4-2-5(9(12)13)8(11)18-6(4)3-7(17-18)10(14,15)16/h2-3,7,9,17H,1H3
InChIKeyAZIIMNXWTBLCEC-UHFFFAOYSA-N
MW286.63 g/mol
LogP3.30
Rot. Bonds1

About 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine

7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine (PubChem CID 134468902) has the molecular formula C10H8ClF5N2 and a molecular weight of 286.63 g/mol. Its IUPAC name is 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine
PubChem CID134468902
Molecular FormulaC10H8ClF5N2
Molecular Weight286.63 g/mol
Exact Mass286.03
IUPAC Name7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine
SMILESCC1=CC(C(F)F)=C(Cl)N2NC(C(F)(F)F)C=C12
InChIInChI=1S/C10H8ClF5N2/c1-4-2-5(9(12)13)8(11)18-6(4)3-7(17-18)10(14,15)16/h2-3,7,9,17H,1H3
InChIKeyAZIIMNXWTBLCEC-UHFFFAOYSA-N
XLogP3.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.63
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine?
The IUPAC name of 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine (CID 134468902) is 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine is CC1=CC(C(F)F)=C(Cl)N2NC(C(F)(F)F)C=C12.
What is the InChIKey of 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine?
The InChIKey is AZIIMNXWTBLCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClF5N2/c1-4-2-5(9(12)13)8(11)18-6(4)3-7(17-18)10(14,15)16/h2-3,7,9,17H,1H3.
What are the key properties of 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine?
7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine has a molecular weight of 286.63 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6-(difluoromethyl)-4-methyl-2-(trifluoromethyl)-1,2-dihydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 134468902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).