1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine

C18H23NO — CID 103433454

IUPAC1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine
SMILESCOc1c(C(N)Cc2ccc(C)cc2)ccc(C)c1C
InChIInChI=1S/C18H23NO/c1-12-5-8-15(9-6-12)11-17(19)16-10-7-13(2)14(3)18(16)20-4/h5-10,17H,11,19H2,1-4H3
InChIKeyMQGROAZOXFQVNX-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.86
Rot. Bonds4

About 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine

1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine (PubChem CID 103433454) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine
PubChem CID103433454
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine
SMILESCOc1c(C(N)Cc2ccc(C)cc2)ccc(C)c1C
InChIInChI=1S/C18H23NO/c1-12-5-8-15(9-6-12)11-17(19)16-10-7-13(2)14(3)18(16)20-4/h5-10,17H,11,19H2,1-4H3
InChIKeyMQGROAZOXFQVNX-UHFFFAOYSA-N
XLogP3.86
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433297
3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine
CID 103435571
2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433437
2-(2,4-difluorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433543
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 103433481
(2-chloro-4-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanamine
CID 106858983
2-(4-bromophenyl)sulfanyl-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433633
1-(2-methoxy-3,4-dimethylphenyl)-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
CID 103475167
1-(2-methoxy-3,4-dimethylphenyl)-2-propylpentan-1-amine
CID 103435574
2-(3-chlorophenoxy)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103435231
(2-methoxy-3,4-dimethylphenyl)-(4-methyl-2-pyridinyl)methanamine
CID 103433515
[1-(2-methoxy-3,4-dimethylphenyl)-2-(3-methylphenyl)ethyl]hydrazine
CID 103435882

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine?
The IUPAC name of 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine (CID 103433454) is 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine.
What is the SMILES notation for 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine?
The canonical SMILES for 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine is COc1c(C(N)Cc2ccc(C)cc2)ccc(C)c1C.
What is the InChIKey of 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine?
The InChIKey is MQGROAZOXFQVNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-12-5-8-15(9-6-12)11-17(19)16-10-7-13(2)14(3)18(16)20-4/h5-10,17H,11,19H2,1-4H3.
What are the key properties of 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine?
1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine has a molecular weight of 269.39 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine is sourced from PubChem (CID 103433454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).