6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine

C22H15FN4 — CID 86766659

IUPAC6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine
SMILESFc1ccccc1-c1ccc2nccc(Nc3cccc4[nH]ncc34)c2c1
InChIInChI=1S/C22H15FN4/c23-18-5-2-1-4-15(18)14-8-9-19-16(12-14)21(10-11-24-19)26-20-6-3-7-22-17(20)13-25-27-22/h1-13H,(H,24,26)(H,25,27)
InChIKeyURJKXHQBSGCFJP-UHFFFAOYSA-N
MW354.39 g/mol
LogP5.66
Rot. Bonds3

About 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine

6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine (PubChem CID 86766659) has the molecular formula C22H15FN4 and a molecular weight of 354.39 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine.

Molecular Properties

Compound Name6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine
PubChem CID86766659
Molecular FormulaC22H15FN4
Molecular Weight354.39 g/mol
Exact Mass354.13
IUPAC Name6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine
SMILESFc1ccccc1-c1ccc2nccc(Nc3cccc4[nH]ncc34)c2c1
InChIInChI=1S/C22H15FN4/c23-18-5-2-1-4-15(18)14-8-9-19-16(12-14)21(10-11-24-19)26-20-6-3-7-22-17(20)13-25-27-22/h1-13H,(H,24,26)(H,25,27)
InChIKeyURJKXHQBSGCFJP-UHFFFAOYSA-N
XLogP5.66
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.39
LogP ≤ 55.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-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 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine?
The IUPAC name of 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine (CID 86766659) is 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine.
What is the SMILES notation for 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine?
The canonical SMILES for 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine is Fc1ccccc1-c1ccc2nccc(Nc3cccc4[nH]ncc34)c2c1.
What is the InChIKey of 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine?
The InChIKey is URJKXHQBSGCFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN4/c23-18-5-2-1-4-15(18)14-8-9-19-16(12-14)21(10-11-24-19)26-20-6-3-7-22-17(20)13-25-27-22/h1-13H,(H,24,26)(H,25,27).
What are the key properties of 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine?
6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine has a molecular weight of 354.39 g/mol, XLogP of 5.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-N-(1H-indazol-4-yl)quinolin-4-amine is sourced from PubChem (CID 86766659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).