2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine

C17H19Cl2NO — CID 63414322

IUPAC2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine
SMILESCCNC(Cc1c(Cl)cccc1Cl)c1ccccc1OC
InChIInChI=1S/C17H19Cl2NO/c1-3-20-16(12-7-4-5-10-17(12)21-2)11-13-14(18)8-6-9-15(13)19/h4-10,16,20H,3,11H2,1-2H3
InChIKeyHEAXKTVJYJKCAI-UHFFFAOYSA-N
MW324.25 g/mol
LogP4.90
Rot. Bonds6

About 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine

2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine (PubChem CID 63414322) has the molecular formula C17H19Cl2NO and a molecular weight of 324.25 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine
PubChem CID63414322
Molecular FormulaC17H19Cl2NO
Molecular Weight324.25 g/mol
Exact Mass323.08
IUPAC Name2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine
SMILESCCNC(Cc1c(Cl)cccc1Cl)c1ccccc1OC
InChIInChI=1S/C17H19Cl2NO/c1-3-20-16(12-7-4-5-10-17(12)21-2)11-13-14(18)8-6-9-15(13)19/h4-10,16,20H,3,11H2,1-2H3
InChIKeyHEAXKTVJYJKCAI-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

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Related Compounds

1-(2-bromophenyl)-2-(2,6-dichlorophenyl)-N-ethylethanamine
CID 63415000
2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methylsulfanylphenyl)ethanamine
CID 115830311
N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 62066193
1-(3-bromo-2-fluorophenyl)-2-(2,6-dichlorophenyl)-N-ethylethanamine
CID 106645460
1-(5-chloro-2-fluorophenyl)-2-(2,6-dichlorophenyl)-N-ethylethanamine
CID 114886290
N-[(3-chloro-2-methylphenyl)-(2-methoxyphenyl)methyl]ethanamine
CID 107102020
2-(2,4-difluorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 62196391
2-(2-chloro-6-fluorophenyl)-N-ethyl-1-(2-methylphenyl)ethanamine
CID 63413996
2-(2,6-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-ethylethanamine
CID 63415329
1-(2-bromo-4-fluorophenyl)-2-(2,6-dichlorophenyl)-N-ethylethanamine
CID 115830230
1-(2-chlorophenyl)-N-ethyl-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 62604347
1-(2-chloro-6-methoxyphenyl)-N-ethylethane-1,2-diamine
CID 104816313

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine (CID 63414322) is 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine is CCNC(Cc1c(Cl)cccc1Cl)c1ccccc1OC.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine?
The InChIKey is HEAXKTVJYJKCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19Cl2NO/c1-3-20-16(12-7-4-5-10-17(12)21-2)11-13-14(18)8-6-9-15(13)19/h4-10,16,20H,3,11H2,1-2H3.
What are the key properties of 2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine?
2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine 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-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine is sourced from PubChem (CID 63414322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).