1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine

C18H17FN2 — CID 114833902

IUPAC1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine
SMILESCC(N)(Cc1ccc(F)cc1)c1cnc2ccccc2c1
InChIInChI=1S/C18H17FN2/c1-18(20,11-13-6-8-16(19)9-7-13)15-10-14-4-2-3-5-17(14)21-12-15/h2-10,12H,11,20H2,1H3
InChIKeyFGMPWERAAVQEPT-UHFFFAOYSA-N
MW280.35 g/mol
LogP3.79
Rot. Bonds3

About 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine

1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine (PubChem CID 114833902) has the molecular formula C18H17FN2 and a molecular weight of 280.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine
PubChem CID114833902
Molecular FormulaC18H17FN2
Molecular Weight280.35 g/mol
Exact Mass280.14
IUPAC Name1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine
SMILESCC(N)(Cc1ccc(F)cc1)c1cnc2ccccc2c1
InChIInChI=1S/C18H17FN2/c1-18(20,11-13-6-8-16(19)9-7-13)15-10-14-4-2-3-5-17(14)21-12-15/h2-10,12H,11,20H2,1H3
InChIKeyFGMPWERAAVQEPT-UHFFFAOYSA-N
XLogP3.79
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluorophenyl)-1-(4-fluorophenyl)propan-2-amine
CID 60798625
1-(4-fluorophenyl)-2-pyrimidin-2-ylpropan-2-amine
CID 165485022
1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 114833903
2-(4-fluorophenyl)-1-(4-methylphenyl)propan-2-amine
CID 60799223
4-methyl-4-quinolin-3-ylpentan-2-amine
CID 64718063
1-(7-tert-butylnaphthalen-2-yl)-2-quinolin-3-ylpropan-2-ol
CID 91563898
1-(4-fluorophenyl)-2-(3-propylphenyl)propan-2-amine
CID 114833794
3-[4-(4-fluorophenyl)phenyl]quinoline
CID 171056588
3-[(4-fluorophenoxy)methyl]quinoline
CID 174564086
3-(2,2,2-trifluoroethyl)quinoline
CID 102230069
2-(5-fluoro-2-methylphenyl)-1-(4-fluorophenyl)propan-2-amine
CID 114833839
6-tert-butyl-2-(2-methyl-2-quinolin-3-ylpropyl)quinoline
CID 131975391

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine (CID 114833902) is 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine is CC(N)(Cc1ccc(F)cc1)c1cnc2ccccc2c1.
What is the InChIKey of 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine?
The InChIKey is FGMPWERAAVQEPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2/c1-18(20,11-13-6-8-16(19)9-7-13)15-10-14-4-2-3-5-17(14)21-12-15/h2-10,12H,11,20H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine?
1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine has a molecular weight of 280.35 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine is sourced from PubChem (CID 114833902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).