4-(2,5-difluorophenyl)sulfanylquinolin-3-amine

C15H10F2N2S — CID 103963881

IUPAC4-(2,5-difluorophenyl)sulfanylquinolin-3-amine
SMILESNc1cnc2ccccc2c1Sc1cc(F)ccc1F
InChIInChI=1S/C15H10F2N2S/c16-9-5-6-11(17)14(7-9)20-15-10-3-1-2-4-13(10)19-8-12(15)18/h1-8H,18H2
InChIKeyLVIRONVPQSLXPB-UHFFFAOYSA-N
MW288.32 g/mol
LogP4.25
Rot. Bonds2

About 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine

4-(2,5-difluorophenyl)sulfanylquinolin-3-amine (PubChem CID 103963881) has the molecular formula C15H10F2N2S and a molecular weight of 288.32 g/mol. Its IUPAC name is 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine.

Molecular Properties

Compound Name4-(2,5-difluorophenyl)sulfanylquinolin-3-amine
PubChem CID103963881
Molecular FormulaC15H10F2N2S
Molecular Weight288.32 g/mol
Exact Mass288.05
IUPAC Name4-(2,5-difluorophenyl)sulfanylquinolin-3-amine
SMILESNc1cnc2ccccc2c1Sc1cc(F)ccc1F
InChIInChI=1S/C15H10F2N2S/c16-9-5-6-11(17)14(7-9)20-15-10-3-1-2-4-13(10)19-8-12(15)18/h1-8H,18H2
InChIKeyLVIRONVPQSLXPB-UHFFFAOYSA-N
XLogP4.25
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2,5-difluorophenyl)sulfanylquinolin-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 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine?
The IUPAC name of 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine (CID 103963881) is 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine.
What is the SMILES notation for 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine?
The canonical SMILES for 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine is Nc1cnc2ccccc2c1Sc1cc(F)ccc1F.
What is the InChIKey of 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine?
The InChIKey is LVIRONVPQSLXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2S/c16-9-5-6-11(17)14(7-9)20-15-10-3-1-2-4-13(10)19-8-12(15)18/h1-8H,18H2.
What are the key properties of 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine?
4-(2,5-difluorophenyl)sulfanylquinolin-3-amine has a molecular weight of 288.32 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-difluorophenyl)sulfanylquinolin-3-amine is sourced from PubChem (CID 103963881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).