2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride

C15H14Cl5NO — CID 175674542

IUPAC2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride
SMILESCl.NCC(OCc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H13Cl4NO.ClH/c16-10-2-1-9(13(18)5-10)8-21-15(7-20)12-4-3-11(17)6-14(12)19;/h1-6,15H,7-8,20H2;1H
InChIKeyMAJAHPYOGXQJQG-UHFFFAOYSA-N
MW401.55 g/mol
LogP5.94
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride

2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride (PubChem CID 175674542) has the molecular formula C15H14Cl5NO and a molecular weight of 401.55 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride
PubChem CID175674542
Molecular FormulaC15H14Cl5NO
Molecular Weight401.55 g/mol
Exact Mass398.95
IUPAC Name2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride
SMILESCl.NCC(OCc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H13Cl4NO.ClH/c16-10-2-1-9(13(18)5-10)8-21-15(7-20)12-4-3-11(17)6-14(12)19;/h1-6,15H,7-8,20H2;1H
InChIKeyMAJAHPYOGXQJQG-UHFFFAOYSA-N
XLogP5.94
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.55
LogP ≤ 55.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride 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

(2R)-2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine
CID 156596799
2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanol
CID 70556653
N-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]formamide
CID 15111116
2,4-dichloro-1-[1-[(4-chloro-2-methylphenyl)methoxy]propyl]benzene
CID 143164368
2-(2-chlorophenyl)-2-[(2-chlorophenyl)methoxy]ethanamine
CID 55022331
1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazole;rhodium
CID 142358126
1-[bis(4-chlorophenyl)methyl]-3-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-2H-imidazole;hydrochloride
CID 91982160
1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-3-ethylimidazol-1-ium;chloride;dihydrochloride
CID 161296312
1-[bis(4-chlorophenyl)methyl]-3-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazolidine
CID 161434696
2-[(2,4-dichlorophenyl)methoxy]ethanamine
CID 14821323
bis(2-(2,4-dichlorophenyl)ethanamine);hydrochloride
CID 175176503
1,2-bis(2,4-dichlorophenyl)ethylhydrazine
CID 105295029

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride?
The IUPAC name of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride (CID 175674542) is 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride?
The canonical SMILES for 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride is Cl.NCC(OCc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride?
The InChIKey is MAJAHPYOGXQJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl4NO.ClH/c16-10-2-1-9(13(18)5-10)8-21-15(7-20)12-4-3-11(17)6-14(12)19;/h1-6,15H,7-8,20H2;1H.
What are the key properties of 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride?
2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride has a molecular weight of 401.55 g/mol, XLogP of 5.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethanamine;hydrochloride is sourced from PubChem (CID 175674542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).