3-(difluoromethyl)-4,5-dimethyl-2H-indazole

C10H10F2N2 — CID 168819075

IUPAC3-(difluoromethyl)-4,5-dimethyl-2H-indazole
SMILESCc1ccc2n[nH]c(C(F)F)c2c1C
InChIInChI=1S/C10H10F2N2/c1-5-3-4-7-8(6(5)2)9(10(11)12)14-13-7/h3-4,10H,1-2H3,(H,13,14)
InChIKeyDBDPZICDVSYNLR-UHFFFAOYSA-N
MW196.20 g/mol
LogP3.12
Rot. Bonds1

About 3-(difluoromethyl)-4,5-dimethyl-2H-indazole

3-(difluoromethyl)-4,5-dimethyl-2H-indazole (PubChem CID 168819075) has the molecular formula C10H10F2N2 and a molecular weight of 196.20 g/mol. Its IUPAC name is 3-(difluoromethyl)-4,5-dimethyl-2H-indazole.

Molecular Properties

Compound Name3-(difluoromethyl)-4,5-dimethyl-2H-indazole
PubChem CID168819075
Molecular FormulaC10H10F2N2
Molecular Weight196.20 g/mol
Exact Mass196.08
IUPAC Name3-(difluoromethyl)-4,5-dimethyl-2H-indazole
SMILESCc1ccc2n[nH]c(C(F)F)c2c1C
InChIInChI=1S/C10H10F2N2/c1-5-3-4-7-8(6(5)2)9(10(11)12)14-13-7/h3-4,10H,1-2H3,(H,13,14)
InChIKeyDBDPZICDVSYNLR-UHFFFAOYSA-N
XLogP3.12
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(difluoromethyl)-4,5-dimethyl-2H-indazole 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 3-(difluoromethyl)-4,5-dimethyl-2H-indazole?
The IUPAC name of 3-(difluoromethyl)-4,5-dimethyl-2H-indazole (CID 168819075) is 3-(difluoromethyl)-4,5-dimethyl-2H-indazole.
What is the SMILES notation for 3-(difluoromethyl)-4,5-dimethyl-2H-indazole?
The canonical SMILES for 3-(difluoromethyl)-4,5-dimethyl-2H-indazole is Cc1ccc2n[nH]c(C(F)F)c2c1C.
What is the InChIKey of 3-(difluoromethyl)-4,5-dimethyl-2H-indazole?
The InChIKey is DBDPZICDVSYNLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2/c1-5-3-4-7-8(6(5)2)9(10(11)12)14-13-7/h3-4,10H,1-2H3,(H,13,14).
What are the key properties of 3-(difluoromethyl)-4,5-dimethyl-2H-indazole?
3-(difluoromethyl)-4,5-dimethyl-2H-indazole has a molecular weight of 196.20 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-4,5-dimethyl-2H-indazole is sourced from PubChem (CID 168819075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).