N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine

C13H8ClF2N3 — CID 24987278

IUPACN-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine
SMILESFc1cc(F)c2[nH]nc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C13H8ClF2N3/c14-7-2-1-3-9(4-7)17-13-10-5-8(15)6-11(16)12(10)18-19-13/h1-6H,(H2,17,18,19)
InChIKeyYYWJTFMVQNEFGC-UHFFFAOYSA-N
MW279.68 g/mol
LogP4.24
Rot. Bonds2

About N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine

N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine (PubChem CID 24987278) has the molecular formula C13H8ClF2N3 and a molecular weight of 279.68 g/mol. Its IUPAC name is N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine
PubChem CID24987278
Molecular FormulaC13H8ClF2N3
Molecular Weight279.68 g/mol
Exact Mass279.04
IUPAC NameN-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine
SMILESFc1cc(F)c2[nH]nc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C13H8ClF2N3/c14-7-2-1-3-9(4-7)17-13-10-5-8(15)6-11(16)12(10)18-19-13/h1-6H,(H2,17,18,19)
InChIKeyYYWJTFMVQNEFGC-UHFFFAOYSA-N
XLogP4.24
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.68
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine 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 N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine?
The IUPAC name of N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine (CID 24987278) is N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine.
What is the SMILES notation for N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine?
The canonical SMILES for N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine is Fc1cc(F)c2[nH]nc(Nc3cccc(Cl)c3)c2c1.
What is the InChIKey of N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine?
The InChIKey is YYWJTFMVQNEFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClF2N3/c14-7-2-1-3-9(4-7)17-13-10-5-8(15)6-11(16)12(10)18-19-13/h1-6H,(H2,17,18,19).
What are the key properties of N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine?
N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine has a molecular weight of 279.68 g/mol, XLogP of 4.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine is sourced from PubChem (CID 24987278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).