2-(2-benzyl-5-fluorophenyl)ethanamine

C15H16FN — CID 20642641

IUPAC2-(2-benzyl-5-fluorophenyl)ethanamine
SMILESNCCc1cc(F)ccc1Cc1ccccc1
InChIInChI=1S/C15H16FN/c16-15-7-6-13(14(11-15)8-9-17)10-12-4-2-1-3-5-12/h1-7,11H,8-10,17H2
InChIKeyJEWHPPPGYMYGEM-UHFFFAOYSA-N
MW229.30 g/mol
LogP2.92
Rot. Bonds4

About 2-(2-benzyl-5-fluorophenyl)ethanamine

2-(2-benzyl-5-fluorophenyl)ethanamine (PubChem CID 20642641) has the molecular formula C15H16FN and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-(2-benzyl-5-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-benzyl-5-fluorophenyl)ethanamine
PubChem CID20642641
Molecular FormulaC15H16FN
Molecular Weight229.30 g/mol
Exact Mass229.13
IUPAC Name2-(2-benzyl-5-fluorophenyl)ethanamine
SMILESNCCc1cc(F)ccc1Cc1ccccc1
InChIInChI=1S/C15H16FN/c16-15-7-6-13(14(11-15)8-9-17)10-12-4-2-1-3-5-12/h1-7,11H,8-10,17H2
InChIKeyJEWHPPPGYMYGEM-UHFFFAOYSA-N
XLogP2.92
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[5-fluoro-2-(3-phenylpropoxy)phenyl]ethanamine
CID 107699954
2-benzyl-5-fluorobenzonitrile
CID 166114436
2-benzyl-4-fluorobenzoic acid
CID 68960960
2-(4-fluoro-2-methoxyphenyl)ethanamine
CID 55254856
(2-benzyl-4-fluorophenyl) carbamate
CID 150789163
2-[5-fluoro-2-(2-phenoxyethoxy)phenyl]ethanamine
CID 107700188
2-(2-aminoethyl)-4-fluoro-N-(2-methylphenyl)aniline
CID 82294339
2-(2-aminoethyl)-4-fluoro-N-(2-fluorophenyl)aniline
CID 82296258
[2-(benzylsulfanylmethyl)-5-fluorophenyl]methanamine
CID 55172896
3-fluoro-4-[(4-fluorophenyl)methyl]aniline
CID 22600023
3-[(2,5-difluorophenyl)methyl]aniline
CID 116925761
N'-[(2,4-difluorophenyl)methyl]-N'-(2-phenylethyl)ethane-1,2-diamine;hydrochloride
CID 120871833

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzyl-5-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-benzyl-5-fluorophenyl)ethanamine (CID 20642641) is 2-(2-benzyl-5-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-benzyl-5-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-benzyl-5-fluorophenyl)ethanamine is NCCc1cc(F)ccc1Cc1ccccc1.
What is the InChIKey of 2-(2-benzyl-5-fluorophenyl)ethanamine?
The InChIKey is JEWHPPPGYMYGEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN/c16-15-7-6-13(14(11-15)8-9-17)10-12-4-2-1-3-5-12/h1-7,11H,8-10,17H2.
What are the key properties of 2-(2-benzyl-5-fluorophenyl)ethanamine?
2-(2-benzyl-5-fluorophenyl)ethanamine has a molecular weight of 229.30 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzyl-5-fluorophenyl)ethanamine is sourced from PubChem (CID 20642641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).