1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine

C16H15F4N — CID 114833903

IUPAC1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine
SMILESCC(N)(Cc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C16H15F4N/c1-15(21,10-11-2-8-14(17)9-3-11)12-4-6-13(7-5-12)16(18,19)20/h2-9H,10,21H2,1H3
InChIKeyULRRFDHAFCUQJZ-UHFFFAOYSA-N
MW297.30 g/mol
LogP4.26
Rot. Bonds3

About 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine

1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine (PubChem CID 114833903) has the molecular formula C16H15F4N and a molecular weight of 297.30 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine
PubChem CID114833903
Molecular FormulaC16H15F4N
Molecular Weight297.30 g/mol
Exact Mass297.11
IUPAC Name1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine
SMILESCC(N)(Cc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C16H15F4N/c1-15(21,10-11-2-8-14(17)9-3-11)12-4-6-13(7-5-12)16(18,19)20/h2-9H,10,21H2,1H3
InChIKeyULRRFDHAFCUQJZ-UHFFFAOYSA-N
XLogP4.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.30
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-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-(4-fluorophenyl)-1-(4-methylphenyl)propan-2-amine
CID 60799223
2-(3-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 62621068
2-(3-fluorophenyl)-1-(4-fluorophenyl)propan-2-amine
CID 60798625
1-(2,2-dimethylpropyl)-4-(trifluoromethyl)benzene
CID 14921472
2-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 173297949
1-(4-fluorophenyl)-2-methylpropan-2-amine;hydrochloride
CID 22597146
2-(4-fluorophenyl)propane-1,2-diamine
CID 116855534
2,2-dimethyl-3-[4-(trifluoromethyl)phenyl]propan-1-amine
CID 62740976
2-(4-fluorophenyl)propan-2-amine
CID 13025665
1-(3,3,3-trifluoro-2,2-dimethylpropyl)-4-(trifluoromethyl)benzene
CID 139245832
1,2-bis(4-methoxyphenyl)propan-2-amine
CID 63273092
1-(4-fluorophenyl)-2-(3-propylphenyl)propan-2-amine
CID 114833794

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine (CID 114833903) is 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine is CC(N)(Cc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine?
The InChIKey is ULRRFDHAFCUQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F4N/c1-15(21,10-11-2-8-14(17)9-3-11)12-4-6-13(7-5-12)16(18,19)20/h2-9H,10,21H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine?
1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine has a molecular weight of 297.30 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine is sourced from PubChem (CID 114833903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).