1-(2,5-difluorophenyl)-2-indazol-1-ylethanone

C15H10F2N2O — CID 62139619

IUPAC1-(2,5-difluorophenyl)-2-indazol-1-ylethanone
SMILESO=C(Cn1ncc2ccccc21)c1cc(F)ccc1F
InChIInChI=1S/C15H10F2N2O/c16-11-5-6-13(17)12(7-11)15(20)9-19-14-4-2-1-3-10(14)8-18-19/h1-8H,9H2
InChIKeyJIKPDDNNXVFTHB-UHFFFAOYSA-N
MW272.25 g/mol
LogP3.20
Rot. Bonds3

About 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone

1-(2,5-difluorophenyl)-2-indazol-1-ylethanone (PubChem CID 62139619) has the molecular formula C15H10F2N2O and a molecular weight of 272.25 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2-indazol-1-ylethanone
PubChem CID62139619
Molecular FormulaC15H10F2N2O
Molecular Weight272.25 g/mol
Exact Mass272.08
IUPAC Name1-(2,5-difluorophenyl)-2-indazol-1-ylethanone
SMILESO=C(Cn1ncc2ccccc21)c1cc(F)ccc1F
InChIInChI=1S/C15H10F2N2O/c16-11-5-6-13(17)12(7-11)15(20)9-19-14-4-2-1-3-10(14)8-18-19/h1-8H,9H2
InChIKeyJIKPDDNNXVFTHB-UHFFFAOYSA-N
XLogP3.20
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.25
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone 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 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone?
The IUPAC name of 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone (CID 62139619) is 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone?
The canonical SMILES for 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone is O=C(Cn1ncc2ccccc21)c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone?
The InChIKey is JIKPDDNNXVFTHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O/c16-11-5-6-13(17)12(7-11)15(20)9-19-14-4-2-1-3-10(14)8-18-19/h1-8H,9H2.
What are the key properties of 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone?
1-(2,5-difluorophenyl)-2-indazol-1-ylethanone has a molecular weight of 272.25 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2-indazol-1-ylethanone is sourced from PubChem (CID 62139619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).