1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine

C17H19F2N — CID 43096584

IUPAC1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine
SMILESCCC(NC(C)c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C17H19F2N/c1-3-17(14-6-10-16(19)11-7-14)20-12(2)13-4-8-15(18)9-5-13/h4-12,17,20H,3H2,1-2H3
InChIKeyAMUADWKMIDKTNE-UHFFFAOYSA-N
MW275.34 g/mol
LogP4.77
Rot. Bonds5

About 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine

1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine (PubChem CID 43096584) has the molecular formula C17H19F2N and a molecular weight of 275.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine
PubChem CID43096584
Molecular FormulaC17H19F2N
Molecular Weight275.34 g/mol
Exact Mass275.15
IUPAC Name1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine
SMILESCCC(NC(C)c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C17H19F2N/c1-3-17(14-6-10-16(19)11-7-14)20-12(2)13-4-8-15(18)9-5-13/h4-12,17,20H,3H2,1-2H3
InChIKeyAMUADWKMIDKTNE-UHFFFAOYSA-N
XLogP4.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.34
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluorophenyl)-N-[1-(4-methylphenyl)ethyl]propan-1-amine
CID 60946165
1-(4-fluorophenyl)-N-[(1R)-1-pyridin-4-ylethyl]propan-1-amine
CID 81405768
1-(4-fluorophenyl)-N-[(1S)-1-pyridin-4-ylethyl]propan-1-amine
CID 81405940
N-[1-(4-fluorophenyl)ethyl]-1-(4-methoxyphenyl)propan-1-amine
CID 43180837
2-[1-[1-(4-fluorophenyl)ethylamino]propyl]phenol
CID 43201977
N-[(1R)-1-(4-fluorophenyl)ethyl]-1-(furan-2-yl)propan-1-amine
CID 81350402
1-(3-bromophenyl)-N-[(1R)-1-(4-fluorophenyl)ethyl]propan-1-amine
CID 81351033
N-[1-(4-fluorophenyl)propyl]-3-methylpentan-2-amine
CID 54949998
1-(4-chlorophenyl)-N-[(1S)-1-(4-fluorophenyl)ethyl]butan-1-amine
CID 81351612
1-(4-chlorophenyl)-N-[(1S)-1-(4-chlorophenyl)ethyl]propan-1-amine
CID 81352929
N-[1-(4-fluorophenyl)propyl]-3,3-dimethylbutan-2-amine
CID 104827878
(2R)-2-[[(1S)-1-(4-fluorophenyl)propyl]amino]propan-1-ol
CID 93082731

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine?
The IUPAC name of 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine (CID 43096584) is 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine?
The canonical SMILES for 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine is CCC(NC(C)c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine?
The InChIKey is AMUADWKMIDKTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F2N/c1-3-17(14-6-10-16(19)11-7-14)20-12(2)13-4-8-15(18)9-5-13/h4-12,17,20H,3H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine?
1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine has a molecular weight of 275.34 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-1-amine is sourced from PubChem (CID 43096584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).