3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine

C18H23NO — CID 65444758

IUPAC3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine
SMILESCNC(CCc1ccc(OC)cc1)c1cccc(C)c1
InChIInChI=1S/C18H23NO/c1-14-5-4-6-16(13-14)18(19-2)12-9-15-7-10-17(20-3)11-8-15/h4-8,10-11,13,18-19H,9,12H2,1-3H3
InChIKeyGRPYAIOMEPNOFI-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.90
Rot. Bonds6

About 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine

3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine (PubChem CID 65444758) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine
PubChem CID65444758
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine
SMILESCNC(CCc1ccc(OC)cc1)c1cccc(C)c1
InChIInChI=1S/C18H23NO/c1-14-5-4-6-16(13-14)18(19-2)12-9-15-7-10-17(20-3)11-8-15/h4-8,10-11,13,18-19H,9,12H2,1-3H3
InChIKeyGRPYAIOMEPNOFI-UHFFFAOYSA-N
XLogP3.90
TPSA21.26 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 ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115796419
N-methyl-1-(3-methylphenyl)-3-phenylpropan-1-amine
CID 60818529
1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 43482663
3-(3-methoxyphenyl)-N-methyl-1-phenylpropan-1-amine
CID 54891056
N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105090642
1-(3-chloro-4-iodophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 103215411
1-(3-methoxyphenyl)-N-methyl-4-phenylbutan-1-amine
CID 62606227
1-(3-fluorophenyl)-N-methyl-3-(3-methylphenyl)propan-1-amine
CID 105092929
1-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 43481682
2-(3,4-dimethoxyphenyl)-N-methyl-1-(3-methylphenyl)ethanamine
CID 60864252
N-ethyl-1-(3-iodophenyl)-3-(4-methoxyphenyl)propan-1-amine
CID 115864765
methyl 4-(methylamino)-4-(3-methylphenyl)butanoate
CID 116955565

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine?
The IUPAC name of 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine (CID 65444758) is 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine?
The canonical SMILES for 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine is CNC(CCc1ccc(OC)cc1)c1cccc(C)c1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine?
The InChIKey is GRPYAIOMEPNOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-14-5-4-6-16(13-14)18(19-2)12-9-15-7-10-17(20-3)11-8-15/h4-8,10-11,13,18-19H,9,12H2,1-3H3.
What are the key properties of 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine?
3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine has a molecular weight of 269.39 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine is sourced from PubChem (CID 65444758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).