5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine

C13H9BrFN3 — CID 146486341

IUPAC5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine
SMILESFc1ccc(Nc2cc3[nH]ncc3cc2Br)cc1
InChIInChI=1S/C13H9BrFN3/c14-11-5-8-7-16-18-12(8)6-13(11)17-10-3-1-9(15)2-4-10/h1-7,17H,(H,16,18)
InChIKeyNJOYZPNPYBLAHA-UHFFFAOYSA-N
MW306.14 g/mol
LogP4.21
Rot. Bonds2

About 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine

5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine (PubChem CID 146486341) has the molecular formula C13H9BrFN3 and a molecular weight of 306.14 g/mol. Its IUPAC name is 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine.

Molecular Properties

Compound Name5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine
PubChem CID146486341
Molecular FormulaC13H9BrFN3
Molecular Weight306.14 g/mol
Exact Mass305.00
IUPAC Name5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine
SMILESFc1ccc(Nc2cc3[nH]ncc3cc2Br)cc1
InChIInChI=1S/C13H9BrFN3/c14-11-5-8-7-16-18-12(8)6-13(11)17-10-3-1-9(15)2-4-10/h1-7,17H,(H,16,18)
InChIKeyNJOYZPNPYBLAHA-UHFFFAOYSA-N
XLogP4.21
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.14
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-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 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine?
The IUPAC name of 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine (CID 146486341) is 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine.
What is the SMILES notation for 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine?
The canonical SMILES for 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine is Fc1ccc(Nc2cc3[nH]ncc3cc2Br)cc1.
What is the InChIKey of 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine?
The InChIKey is NJOYZPNPYBLAHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrFN3/c14-11-5-8-7-16-18-12(8)6-13(11)17-10-3-1-9(15)2-4-10/h1-7,17H,(H,16,18).
What are the key properties of 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine?
5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine has a molecular weight of 306.14 g/mol, XLogP of 4.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine is sourced from PubChem (CID 146486341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).