3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine

C15H14F3N — CID 121467476

IUPAC3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine
SMILESNCC(c1ccc(-c2ccccc2)cc1)C(F)(F)F
InChIInChI=1S/C15H14F3N/c16-15(17,18)14(10-19)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14H,10,19H2
InChIKeyLJMRPAXVZDPPJH-UHFFFAOYSA-N
MW265.28 g/mol
LogP3.96
Rot. Bonds3

About 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine

3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine (PubChem CID 121467476) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine.

Molecular Properties

Compound Name3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine
PubChem CID121467476
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine
SMILESNCC(c1ccc(-c2ccccc2)cc1)C(F)(F)F
InChIInChI=1S/C15H14F3N/c16-15(17,18)14(10-19)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14H,10,19H2
InChIKeyLJMRPAXVZDPPJH-UHFFFAOYSA-N
XLogP3.96
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-phenyl-4-[(2S)-1,1,1-trifluoro-4-phenylbutan-2-yl]benzene
CID 139124399
2-phenyl-2-(4-phenylphenyl)ethanamine
CID 44719858
6-amino-4,4-dimethyl-5-(4-phenylphenyl)hexan-2-ol
CID 121454673
2-(3,4-difluorophenyl)-3,3,3-trifluoropropan-1-amine
CID 82534396
(1S)-4,4,4-trifluoro-1-(4-phenylphenyl)butan-1-amine
CID 171228019
3,3,3-trifluoro-2-(1-phenylpyrazol-4-yl)propan-1-amine
CID 82534378
3,3,3-trifluoro-2-(3-methylphenyl)propan-1-amine
CID 79016159
(2R)-2-(3-chlorophenyl)-3,3,3-trifluoropropan-1-amine
CID 96707876
2,2,3,3,3-pentafluoro-1-(4-phenylphenyl)propan-1-amine
CID 43248519
(1R)-1-(4-phenylphenyl)propane-1,3-diamine
CID 171208417
2,2-difluoro-1,3-bis(4-phenylphenyl)propane-1,3-diol
CID 10319715
(1R)-2,2,3,3,3-pentafluoro-1-(4-phenylphenyl)propan-1-amine;hydrochloride
CID 171312478

Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine?
The IUPAC name of 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine (CID 121467476) is 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine.
What is the SMILES notation for 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine?
The canonical SMILES for 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine is NCC(c1ccc(-c2ccccc2)cc1)C(F)(F)F.
What is the InChIKey of 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine?
The InChIKey is LJMRPAXVZDPPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N/c16-15(17,18)14(10-19)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14H,10,19H2.
What are the key properties of 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine?
3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine has a molecular weight of 265.28 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-2-(4-phenylphenyl)propan-1-amine is sourced from PubChem (CID 121467476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).