1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine

C17H21NO — CID 62788691

IUPAC1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine
SMILESCCOc1ccc(C(C)(N)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H21NO/c1-4-19-16-11-9-15(10-12-16)17(3,18)14-7-5-13(2)6-8-14/h5-12H,4,18H2,1-3H3
InChIKeyIAUJXOSPVXWPPB-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.62
Rot. Bonds4

About 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine

1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine (PubChem CID 62788691) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine
PubChem CID62788691
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine
SMILESCCOc1ccc(C(C)(N)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H21NO/c1-4-19-16-11-9-15(10-12-16)17(3,18)14-7-5-13(2)6-8-14/h5-12H,4,18H2,1-3H3
InChIKeyIAUJXOSPVXWPPB-UHFFFAOYSA-N
XLogP3.62
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethoxyphenyl)-1-phenylethanamine
CID 62787644
1-(4-ethoxyphenyl)-1-(3-methylphenyl)ethanamine
CID 55116130
1-ethoxy-4-[4-(4-methylphenoxy)butoxy]benzene
CID 2283416
N-(4-ethoxyphenyl)-N,4-dimethylaniline
CID 20575987
1-(4-fluorophenyl)-1-(4-methylphenyl)ethanamine
CID 60799030
ethyl 3-(4-ethoxyphenyl)-3-hydroxybutanoate
CID 55071355
1-ethoxy-4-methylbenzene;2-methylthiophene
CID 165083853
2,5-bis(4-ethoxyphenyl)thiophene
CID 154402016
2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine
CID 63273223
2-[4-(4-ethoxyphenyl)phenyl]-2-methylpropanenitrile
CID 82091776
[(4-ethoxyphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194292
1-(2,2-dimethylpropoxy)-4-ethoxybenzene
CID 170603637

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine?
The IUPAC name of 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine (CID 62788691) is 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine.
What is the SMILES notation for 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine?
The canonical SMILES for 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine is CCOc1ccc(C(C)(N)c2ccc(C)cc2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine?
The InChIKey is IAUJXOSPVXWPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-4-19-16-11-9-15(10-12-16)17(3,18)14-7-5-13(2)6-8-14/h5-12H,4,18H2,1-3H3.
What are the key properties of 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine?
1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine has a molecular weight of 255.36 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine is sourced from PubChem (CID 62788691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).