2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine

C18H23NO2 — CID 63273223

IUPAC2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine
SMILESCCOc1ccc(C(C)(N)Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C18H23NO2/c1-4-21-17-11-7-15(8-12-17)18(2,19)13-14-5-9-16(20-3)10-6-14/h5-12H,4,13,19H2,1-3H3
InChIKeyZSLYLKGUMNNRHC-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.51
Rot. Bonds6

About 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine

2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine (PubChem CID 63273223) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine
PubChem CID63273223
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine
SMILESCCOc1ccc(C(C)(N)Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C18H23NO2/c1-4-21-17-11-7-15(8-12-17)18(2,19)13-14-5-9-16(20-3)10-6-14/h5-12H,4,13,19H2,1-3H3
InChIKeyZSLYLKGUMNNRHC-UHFFFAOYSA-N
XLogP3.51
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-bis(4-methoxyphenyl)propan-2-amine
CID 63273092
1-(4-methoxyphenyl)-2-(6-methyl-3-pyridinyl)propan-2-amine
CID 55169860
1-[(3S)-4-(4-ethoxyphenyl)-2-(4-ethylphenyl)-2,3,4-trimethylpentan-3-yl]-4-methoxybenzene
CID 170193958
2-(3-fluoro-4-methoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine
CID 63273344
2-(4-methoxyphenyl)pentan-2-amine
CID 43810210
but-2-enedioic acid;2-(4-methoxyphenyl)-1-phenylpropan-2-amine
CID 67712155
1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene
CID 71248389
1-(3-bromo-5-fluorophenyl)-2-(4-methoxyphenyl)propan-2-amine
CID 79702014
1-(4-methoxyphenyl)-2-methyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79824884
2-N',2-N'-diethyl-1-(4-methoxyphenyl)propane-2,2-diamine
CID 84752655
2-(4-methoxyphenyl)heptan-2-amine
CID 62621826
1-(2-bromo-5-methoxyphenyl)-2-(4-ethylphenyl)propan-2-amine
CID 65327325

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine?
The IUPAC name of 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine (CID 63273223) is 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine.
What is the SMILES notation for 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine?
The canonical SMILES for 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine is CCOc1ccc(C(C)(N)Cc2ccc(OC)cc2)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine?
The InChIKey is ZSLYLKGUMNNRHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-4-21-17-11-7-15(8-12-17)18(2,19)13-14-5-9-16(20-3)10-6-14/h5-12H,4,13,19H2,1-3H3.
What are the key properties of 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine?
2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine has a molecular weight of 285.39 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine is sourced from PubChem (CID 63273223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).