1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine

C18H23NO — CID 105018704

IUPAC1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine
SMILESCCc1cccc(C(N)CCc2ccc(OC)cc2)c1
InChIInChI=1S/C18H23NO/c1-3-14-5-4-6-16(13-14)18(19)12-9-15-7-10-17(20-2)11-8-15/h4-8,10-11,13,18H,3,9,12,19H2,1-2H3
InChIKeyULZADZAZONLQLI-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.89
Rot. Bonds6

About 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine

1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine (PubChem CID 105018704) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine
PubChem CID105018704
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine
SMILESCCc1cccc(C(N)CCc2ccc(OC)cc2)c1
InChIInChI=1S/C18H23NO/c1-3-14-5-4-6-16(13-14)18(19)12-9-15-7-10-17(20-2)11-8-15/h4-8,10-11,13,18H,3,9,12,19H2,1-2H3
InChIKeyULZADZAZONLQLI-UHFFFAOYSA-N
XLogP3.89
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine
CID 43099758
1-(3-methoxyphenyl)-3-pyridin-4-ylpropan-1-amine
CID 105086648
1-(3-methoxyphenyl)-3-(3-methylphenyl)propan-1-amine
CID 105086643
1-(3-ethoxyphenyl)-3-phenylpropan-1-amine
CID 60817898
[(3-ethylphenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190750
1-(4-ethylphenyl)-3-(4-methoxyphenyl)propan-1-ol
CID 61089071
1-(4-ethylphenyl)-4-(4-methoxyphenyl)butan-2-amine
CID 115803356
1-[3-(2-methylpropyl)phenyl]-3-phenylpropan-1-amine
CID 116544087
1-(3-propylphenyl)-3-pyridin-4-ylpropan-1-amine
CID 105188013
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methoxyphenyl)propan-1-amine;hydron;chloride
CID 51056094
1-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propan-1-amine
CID 115533560
1-(3-iodophenyl)-3-(4-methoxyphenyl)propan-1-ol
CID 115803162

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine?
The IUPAC name of 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine (CID 105018704) is 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine.
What is the SMILES notation for 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine?
The canonical SMILES for 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine is CCc1cccc(C(N)CCc2ccc(OC)cc2)c1.
What is the InChIKey of 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine?
The InChIKey is ULZADZAZONLQLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-3-14-5-4-6-16(13-14)18(19)12-9-15-7-10-17(20-2)11-8-15/h4-8,10-11,13,18H,3,9,12,19H2,1-2H3.
What are the key properties of 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine?
1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine has a molecular weight of 269.39 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine is sourced from PubChem (CID 105018704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).