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

C17H20ClNO — CID 103433437

IUPAC2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
SMILESCOc1c(C(N)Cc2ccccc2Cl)ccc(C)c1C
InChIInChI=1S/C17H20ClNO/c1-11-8-9-14(17(20-3)12(11)2)16(19)10-13-6-4-5-7-15(13)18/h4-9,16H,10,19H2,1-3H3
InChIKeyOXISHPAQFHMIRU-UHFFFAOYSA-N
MW289.81 g/mol
LogP4.21
Rot. Bonds4

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

2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine (PubChem CID 103433437) has the molecular formula C17H20ClNO and a molecular weight of 289.81 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
PubChem CID103433437
Molecular FormulaC17H20ClNO
Molecular Weight289.81 g/mol
Exact Mass289.12
IUPAC Name2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
SMILESCOc1c(C(N)Cc2ccccc2Cl)ccc(C)c1C
InChIInChI=1S/C17H20ClNO/c1-11-8-9-14(17(20-3)12(11)2)16(19)10-13-6-4-5-7-15(13)18/h4-9,16H,10,19H2,1-3H3
InChIKeyOXISHPAQFHMIRU-UHFFFAOYSA-N
XLogP4.21
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine 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

2-(2-chlorophenyl)-1-(2,3-difluoro-4-methylphenyl)ethanamine
CID 107513256
2-(3-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433297
2-(2,4-difluorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433543
1-(2-methoxy-3,4-dimethylphenyl)-2-(4-methylphenyl)ethanamine
CID 103433454
1-(4-bromo-2-methoxyphenyl)-2-(2-chlorophenyl)ethanamine
CID 115369401
2-(2-chlorophenyl)-1-(2,3,4,5,6-pentamethylphenyl)ethanamine
CID 43110651
2-(3-chlorophenoxy)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103435231
2-(2-chlorophenyl)-1-(2,3,5,6-tetramethylphenyl)ethanamine
CID 43103860
3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine
CID 103435571
2-(3-chloro-2-fluorophenyl)-1-(2,3-dimethoxyphenyl)ethanamine
CID 102867085
(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103443462
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methoxyphenyl)ethanol
CID 103433092

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine?
The IUPAC name of 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine (CID 103433437) is 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine?
The canonical SMILES for 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine is COc1c(C(N)Cc2ccccc2Cl)ccc(C)c1C.
What is the InChIKey of 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine?
The InChIKey is OXISHPAQFHMIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClNO/c1-11-8-9-14(17(20-3)12(11)2)16(19)10-13-6-4-5-7-15(13)18/h4-9,16H,10,19H2,1-3H3.
What are the key properties of 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine?
2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine has a molecular weight of 289.81 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine is sourced from PubChem (CID 103433437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).