2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine

C15H16FN — CID 110282368

IUPAC2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine
SMILESCc1ccc(-c2cccc(CCN)c2)c(F)c1
InChIInChI=1S/C15H16FN/c1-11-5-6-14(15(16)9-11)13-4-2-3-12(10-13)7-8-17/h2-6,9-10H,7-8,17H2,1H3
InChIKeyASMILKJZWNVEMX-UHFFFAOYSA-N
MW229.30 g/mol
LogP3.30
Rot. Bonds3

About 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine

2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine (PubChem CID 110282368) has the molecular formula C15H16FN and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine
PubChem CID110282368
Molecular FormulaC15H16FN
Molecular Weight229.30 g/mol
Exact Mass229.13
IUPAC Name2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine
SMILESCc1ccc(-c2cccc(CCN)c2)c(F)c1
InChIInChI=1S/C15H16FN/c1-11-5-6-14(15(16)9-11)13-4-2-3-12(10-13)7-8-17/h2-6,9-10H,7-8,17H2,1H3
InChIKeyASMILKJZWNVEMX-UHFFFAOYSA-N
XLogP3.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3-(2,4-dimethylphenyl)phenyl]ethanamine
CID 82115094
2-[3-(4-methylphenyl)phenyl]ethanamine
CID 66523842
2-fluoro-4-methyl-1-(3-methylphenyl)benzene
CID 142157742
2-(3-methylphenyl)ethanamine;hydrochloride
CID 47003273
3-fluoro-4-[3-(2-methylpropyl)phenyl]aniline
CID 116545257
2-[3-(5-methyl-1H-pyrazol-4-yl)phenyl]ethanamine
CID 39222030
1-(4-ethylphenyl)-2-fluoro-4-(2-fluoro-4-methylphenyl)benzene
CID 169027138
[4-(2-fluoro-4-methylphenyl)-2,6-dimethylphenyl]methanamine
CID 172876736
2-[3-(7-methyl-9H-pyrido[2,3-b]indol-4-yl)phenyl]ethanamine
CID 118674112
2-fluoro-1-[4-(fluoromethyl)phenyl]-4-methylbenzene
CID 59215467
1,4-dimethyl-2-(3-propylphenyl)benzene
CID 173395390
4-[3-(2-aminoethyl)phenyl]-5-methyl-2-propan-2-ylphenol
CID 82039594

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine?
The IUPAC name of 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine (CID 110282368) is 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine.
What is the SMILES notation for 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine?
The canonical SMILES for 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine is Cc1ccc(-c2cccc(CCN)c2)c(F)c1.
What is the InChIKey of 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine?
The InChIKey is ASMILKJZWNVEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN/c1-11-5-6-14(15(16)9-11)13-4-2-3-12(10-13)7-8-17/h2-6,9-10H,7-8,17H2,1H3.
What are the key properties of 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine?
2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine has a molecular weight of 229.30 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-fluoro-4-methylphenyl)phenyl]ethanamine is sourced from PubChem (CID 110282368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).