2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine

C17H19Cl2NO — CID 63414164

IUPAC2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine
SMILESCCNC(Cc1cc(Cl)ccc1OC)c1ccc(Cl)cc1
InChIInChI=1S/C17H19Cl2NO/c1-3-20-16(12-4-6-14(18)7-5-12)11-13-10-15(19)8-9-17(13)21-2/h4-10,16,20H,3,11H2,1-2H3
InChIKeyPUAOCRMIHNQCMI-UHFFFAOYSA-N
MW324.25 g/mol
LogP4.90
Rot. Bonds6

About 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine

2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine (PubChem CID 63414164) has the molecular formula C17H19Cl2NO and a molecular weight of 324.25 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine
PubChem CID63414164
Molecular FormulaC17H19Cl2NO
Molecular Weight324.25 g/mol
Exact Mass323.08
IUPAC Name2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine
SMILESCCNC(Cc1cc(Cl)ccc1OC)c1ccc(Cl)cc1
InChIInChI=1S/C17H19Cl2NO/c1-3-20-16(12-4-6-14(18)7-5-12)11-13-10-15(19)8-9-17(13)21-2/h4-10,16,20H,3,11H2,1-2H3
InChIKeyPUAOCRMIHNQCMI-UHFFFAOYSA-N
XLogP4.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.25
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine 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-(5-chloro-2-methoxyphenyl)-N-ethyl-1-(4-iodophenyl)ethanamine
CID 115844893
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-pyrimidin-5-ylethanamine
CID 102923380
2-(5-chloro-2-methoxyphenyl)-1-(5-chlorothiophen-2-yl)-N-ethylethanamine
CID 115844898
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-(5-ethylthiophen-2-yl)ethanamine
CID 115844980
2-(5-chloro-2-methoxyphenyl)-1-(3-chloro-4-methylthiophen-2-yl)-N-ethylethanamine
CID 103405686
1-(5-chloro-2-methoxyphenyl)-N-ethyl-3,3-dimethylbutan-2-amine
CID 62601354
2-(4-chloro-2-fluorophenyl)-N-ethyl-1-(4-methoxyphenyl)ethanamine
CID 114855165
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 105137382
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530726
3-[(5-chloro-2-methoxyphenyl)methyl]-N-ethyl-4-methylpentan-2-amine
CID 62916009
2-(5-bromo-2-methoxyphenyl)-1-(4-chlorophenyl)-N-methylethanamine
CID 63414513
N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine
CID 62161192

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine?
The IUPAC name of 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine (CID 63414164) is 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine.
What is the SMILES notation for 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine?
The canonical SMILES for 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine is CCNC(Cc1cc(Cl)ccc1OC)c1ccc(Cl)cc1.
What is the InChIKey of 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine?
The InChIKey is PUAOCRMIHNQCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19Cl2NO/c1-3-20-16(12-4-6-14(18)7-5-12)11-13-10-15(19)8-9-17(13)21-2/h4-10,16,20H,3,11H2,1-2H3.
What are the key properties of 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine?
2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine has a molecular weight of 324.25 g/mol, XLogP of 4.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine is sourced from PubChem (CID 63414164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).