1-[3-(4-ethylphenyl)phenyl]ethanamine

C16H19N — CID 55134062

IUPAC1-[3-(4-ethylphenyl)phenyl]ethanamine
SMILESCCc1ccc(-c2cccc(C(C)N)c2)cc1
InChIInChI=1S/C16H19N/c1-3-13-7-9-14(10-8-13)16-6-4-5-15(11-16)12(2)17/h4-12H,3,17H2,1-2H3
InChIKeyBYXPUCXPWAGOAP-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.94
Rot. Bonds3

About 1-[3-(4-ethylphenyl)phenyl]ethanamine

1-[3-(4-ethylphenyl)phenyl]ethanamine (PubChem CID 55134062) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-[3-(4-ethylphenyl)phenyl]ethanamine.

Molecular Properties

Compound Name1-[3-(4-ethylphenyl)phenyl]ethanamine
PubChem CID55134062
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name1-[3-(4-ethylphenyl)phenyl]ethanamine
SMILESCCc1ccc(-c2cccc(C(C)N)c2)cc1
InChIInChI=1S/C16H19N/c1-3-13-7-9-14(10-8-13)16-6-4-5-15(11-16)12(2)17/h4-12H,3,17H2,1-2H3
InChIKeyBYXPUCXPWAGOAP-UHFFFAOYSA-N
XLogP3.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[3-[4-[(dimethylamino)methyl]phenyl]phenyl]ethanamine
CID 82541578
(1R)-1-(3-ethylphenyl)ethanamine
CID 55277637
1-[3-(4-ethoxyphenyl)phenyl]ethanamine
CID 54912028
1-[3-(4-fluorophenyl)phenyl]ethanamine
CID 61026318
(1R)-1-(4-ethylphenyl)ethanamine
CID 2063952
(1R)-1-[3-(4-phenylmethoxyphenyl)phenyl]ethanamine;hydrochloride
CID 171391010
1-[3-(4-ethylphenyl)phenyl]-N-propylpropan-1-amine
CID 63424575
1-ethyl-4-(3-methylphenyl)benzene
CID 12641077
1-[3-(3,5-difluorophenyl)phenyl]ethanamine
CID 54911738
(1S)-1-[3-(3-methoxyphenyl)phenyl]ethanamine
CID 93461021
N-[4-[3-[(1S)-1-aminoethyl]phenyl]phenyl]methanesulfonamide
CID 59506232
1-[4-(4-ethylphenyl)phenyl]ethanol
CID 139710223

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-ethylphenyl)phenyl]ethanamine?
The IUPAC name of 1-[3-(4-ethylphenyl)phenyl]ethanamine (CID 55134062) is 1-[3-(4-ethylphenyl)phenyl]ethanamine.
What is the SMILES notation for 1-[3-(4-ethylphenyl)phenyl]ethanamine?
The canonical SMILES for 1-[3-(4-ethylphenyl)phenyl]ethanamine is CCc1ccc(-c2cccc(C(C)N)c2)cc1.
What is the InChIKey of 1-[3-(4-ethylphenyl)phenyl]ethanamine?
The InChIKey is BYXPUCXPWAGOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-3-13-7-9-14(10-8-13)16-6-4-5-15(11-16)12(2)17/h4-12H,3,17H2,1-2H3.
What are the key properties of 1-[3-(4-ethylphenyl)phenyl]ethanamine?
1-[3-(4-ethylphenyl)phenyl]ethanamine has a molecular weight of 225.33 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-ethylphenyl)phenyl]ethanamine is sourced from PubChem (CID 55134062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).