2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine

C18H22ClNO — CID 63412584

IUPAC2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine
SMILESCCNC(Cc1cccc(Cl)c1)c1ccccc1OCC
InChIInChI=1S/C18H22ClNO/c1-3-20-17(13-14-8-7-9-15(19)12-14)16-10-5-6-11-18(16)21-4-2/h5-12,17,20H,3-4,13H2,1-2H3
InChIKeySCEHQHUSHQTSBZ-UHFFFAOYSA-N
MW303.83 g/mol
LogP4.63
Rot. Bonds7

About 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine

2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine (PubChem CID 63412584) has the molecular formula C18H22ClNO and a molecular weight of 303.83 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine
PubChem CID63412584
Molecular FormulaC18H22ClNO
Molecular Weight303.83 g/mol
Exact Mass303.14
IUPAC Name2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine
SMILESCCNC(Cc1cccc(Cl)c1)c1ccccc1OCC
InChIInChI=1S/C18H22ClNO/c1-3-20-17(13-14-8-7-9-15(19)12-14)16-10-5-6-11-18(16)21-4-2/h5-12,17,20H,3-4,13H2,1-2H3
InChIKeySCEHQHUSHQTSBZ-UHFFFAOYSA-N
XLogP4.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.83
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-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

1-(2-bromophenyl)-2-(3-chlorophenyl)-N-ethylethanamine
CID 63414830
1-(2-ethoxyphenyl)-N-ethyl-2-(4-methylphenyl)ethanamine
CID 61066318
1-(2-chloro-5-fluorophenyl)-2-(3-chlorophenyl)-N-ethylethanamine
CID 105394689
1-(2-ethoxyphenyl)-N-ethyl-2-(4-iodophenyl)ethanamine
CID 115533968
2-(3-chlorophenyl)-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 62503419
2-(3-chlorophenyl)-N-ethyl-1-(4-fluoro-2-methylphenyl)ethanamine
CID 63412552
2-(3-chlorophenyl)-1-(2,4-dibromophenyl)-N-ethylethanamine
CID 107945002
2-(3-chlorophenyl)-N-ethyl-1-(1-ethylimidazol-2-yl)ethanamine
CID 63968122
2-(3-chlorophenyl)-N-ethyl-1-(4-propylphenyl)ethanamine
CID 63412084
1-(2-ethoxyphenyl)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 61066488
2-(3-chlorophenyl)-N-ethyl-1-(3-methoxythiophen-2-yl)ethanamine
CID 81122564
2-(3-chlorophenyl)-N-ethyl-1-(2,4,6-trifluorophenyl)ethanamine
CID 63508626

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
The IUPAC name of 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine (CID 63412584) is 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
The canonical SMILES for 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine is CCNC(Cc1cccc(Cl)c1)c1ccccc1OCC.
What is the InChIKey of 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
The InChIKey is SCEHQHUSHQTSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22ClNO/c1-3-20-17(13-14-8-7-9-15(19)12-14)16-10-5-6-11-18(16)21-4-2/h5-12,17,20H,3-4,13H2,1-2H3.
What are the key properties of 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine?
2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine has a molecular weight of 303.83 g/mol, XLogP of 4.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(2-ethoxyphenyl)-N-ethylethanamine is sourced from PubChem (CID 63412584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).