3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine

C15H25NO2 — CID 103435571

IUPAC3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine
SMILESCOc1c(C(N)CC(C)(C)OC)ccc(C)c1C
InChIInChI=1S/C15H25NO2/c1-10-7-8-12(14(17-5)11(10)2)13(16)9-15(3,4)18-6/h7-8,13H,9,16H2,1-6H3
InChIKeyCBNZHFKOUNRZNL-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.13
Rot. Bonds5

About 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine

3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine (PubChem CID 103435571) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine.

Molecular Properties

Compound Name3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine
PubChem CID103435571
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine
SMILESCOc1c(C(N)CC(C)(C)OC)ccc(C)c1C
InChIInChI=1S/C15H25NO2/c1-10-7-8-12(14(17-5)11(10)2)13(16)9-15(3,4)18-6/h7-8,13H,9,16H2,1-6H3
InChIKeyCBNZHFKOUNRZNL-UHFFFAOYSA-N
XLogP3.13
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-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

1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine
CID 103433454
1-(2,4-dimethoxy-3-methylphenyl)-3-methylbutane-1,3-diamine
CID 116933582
1-(2-methoxy-3,4-dimethylphenyl)-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
CID 103475167
2-(4-bromophenyl)sulfanyl-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433633
2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-methylpropan-1-ol
CID 103433183
[2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-methylbutyl]hydrazine
CID 103436158
1-(2-methoxy-3,4-dimethylphenyl)-2,2-dimethylpropan-1-ol
CID 103432558
3,3,3-trifluoro-1-(2-methoxy-3,4-dimethylphenyl)-2-(trifluoromethyl)propan-1-amine
CID 103435224
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-propylpentan-1-amine
CID 103435574
2-(3-chlorophenoxy)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103435231

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine?
The IUPAC name of 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine (CID 103435571) is 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine.
What is the SMILES notation for 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine?
The canonical SMILES for 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine is COc1c(C(N)CC(C)(C)OC)ccc(C)c1C.
What is the InChIKey of 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine?
The InChIKey is CBNZHFKOUNRZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-10-7-8-12(14(17-5)11(10)2)13(16)9-15(3,4)18-6/h7-8,13H,9,16H2,1-6H3.
What are the key properties of 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine?
3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine is sourced from PubChem (CID 103435571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).