1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine

C15H14F3N — CID 62197982

IUPAC1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine
SMILESCC(N)(Cc1ccc(F)cc1F)c1ccccc1F
InChIInChI=1S/C15H14F3N/c1-15(19,12-4-2-3-5-13(12)17)9-10-6-7-11(16)8-14(10)18/h2-8H,9,19H2,1H3
InChIKeyXFKNEEWRYOJMEG-UHFFFAOYSA-N
MW265.28 g/mol
LogP3.52
Rot. Bonds3

About 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine

1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine (PubChem CID 62197982) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine
PubChem CID62197982
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine
SMILESCC(N)(Cc1ccc(F)cc1F)c1ccccc1F
InChIInChI=1S/C15H14F3N/c1-15(19,12-4-2-3-5-13(12)17)9-10-6-7-11(16)8-14(10)18/h2-8H,9,19H2,1H3
InChIKeyXFKNEEWRYOJMEG-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine?
The IUPAC name of 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine (CID 62197982) is 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine is CC(N)(Cc1ccc(F)cc1F)c1ccccc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine?
The InChIKey is XFKNEEWRYOJMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N/c1-15(19,12-4-2-3-5-13(12)17)9-10-6-7-11(16)8-14(10)18/h2-8H,9,19H2,1H3.
What are the key properties of 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine?
1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine has a molecular weight of 265.28 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine is sourced from PubChem (CID 62197982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).