N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine

C17H20FN — CID 54891295

IUPACN-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine
SMILESCCNC(CCc1ccccc1F)c1ccccc1
InChIInChI=1S/C17H20FN/c1-2-19-17(15-9-4-3-5-10-15)13-12-14-8-6-7-11-16(14)18/h3-11,17,19H,2,12-13H2,1H3
InChIKeyZXRJZWDLWFCRLF-UHFFFAOYSA-N
MW257.35 g/mol
LogP4.11
Rot. Bonds6

About N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine

N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine (PubChem CID 54891295) has the molecular formula C17H20FN and a molecular weight of 257.35 g/mol. Its IUPAC name is N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine
PubChem CID54891295
Molecular FormulaC17H20FN
Molecular Weight257.35 g/mol
Exact Mass257.16
IUPAC NameN-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine
SMILESCCNC(CCc1ccccc1F)c1ccccc1
InChIInChI=1S/C17H20FN/c1-2-19-17(15-9-4-3-5-10-15)13-12-14-8-6-7-11-16(14)18/h3-11,17,19H,2,12-13H2,1H3
InChIKeyZXRJZWDLWFCRLF-UHFFFAOYSA-N
XLogP4.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.35
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-1-phenylbutan-1-amine
CID 43108094
3-(3-bromo-2-fluorophenyl)-N-ethyl-1-phenylpropan-1-amine
CID 106646599
4-(2,6-difluorophenyl)-N-ethyl-1-phenylbutan-1-amine
CID 114934436
3-(2-chloro-6-fluorophenyl)-N-ethyl-1-phenylpropan-1-amine
CID 63400371
N-ethyl-3-(3-fluoro-4-methylphenyl)-1-phenylpropan-1-amine
CID 107129437
N-[(2-fluorophenyl)methyl]-1-phenylbutan-1-amine
CID 17156263
2-(2,3-difluorophenyl)-N-ethyl-1-phenylethanamine
CID 55095211
3-(2,4-dichlorophenyl)-N-ethyl-1-phenylpropan-1-amine
CID 63400282
3-(4-bromo-3-chloro-2-fluorophenyl)-N-ethyl-1-phenylpropan-1-amine
CID 106763459
N-ethyl-3-(2-fluoro-4,6-dimethylphenyl)-1-phenylpropan-1-amine
CID 106882518
3-(3-bromo-2,6-difluorophenyl)-N-ethyl-1-phenylpropan-1-amine
CID 106943528
N-ethyl-3-(5-fluoro-3-pyridinyl)-1-phenylpropan-1-amine
CID 64500356

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine?
The IUPAC name of N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine (CID 54891295) is N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine.
What is the SMILES notation for N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine?
The canonical SMILES for N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine is CCNC(CCc1ccccc1F)c1ccccc1.
What is the InChIKey of N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine?
The InChIKey is ZXRJZWDLWFCRLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN/c1-2-19-17(15-9-4-3-5-10-15)13-12-14-8-6-7-11-16(14)18/h3-11,17,19H,2,12-13H2,1H3.
What are the key properties of N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine?
N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine has a molecular weight of 257.35 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine is sourced from PubChem (CID 54891295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).