1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine

C15H13Br2Cl2N — CID 107947209

IUPAC1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
SMILESCNC(Cc1cccc(Cl)c1Cl)c1ccc(Br)cc1Br
InChIInChI=1S/C15H13Br2Cl2N/c1-20-14(11-6-5-10(16)8-12(11)17)7-9-3-2-4-13(18)15(9)19/h2-6,8,14,20H,7H2,1H3
InChIKeyFUFIOFXBNRQJPJ-UHFFFAOYSA-N
MW437.99 g/mol
LogP6.02
Rot. Bonds4

About 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine

1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine (PubChem CID 107947209) has the molecular formula C15H13Br2Cl2N and a molecular weight of 437.99 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
PubChem CID107947209
Molecular FormulaC15H13Br2Cl2N
Molecular Weight437.99 g/mol
Exact Mass434.88
IUPAC Name1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
SMILESCNC(Cc1cccc(Cl)c1Cl)c1ccc(Br)cc1Br
InChIInChI=1S/C15H13Br2Cl2N/c1-20-14(11-6-5-10(16)8-12(11)17)7-9-3-2-4-13(18)15(9)19/h2-6,8,14,20H,7H2,1H3
InChIKeyFUFIOFXBNRQJPJ-UHFFFAOYSA-N
XLogP6.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.99
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine with MolForge

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Related Compounds

1-(5-bromo-2-methylphenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
CID 107312321
2-(2-chloro-4-methylphenyl)-1-(2,4-dibromophenyl)-N-methylethanamine
CID 107947153
1-(4-bromo-2-chlorophenyl)-2-(2-bromophenyl)-N-methylethanamine
CID 115786767
2-(5-chloro-2-fluorophenyl)-1-(2,4-dibromophenyl)-N-methylethanamine
CID 107947073
1-(4-bromo-3,5-dimethylphenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine
CID 107309145
1-(2-bromo-4-methylphenyl)-2-(2-chloro-3-fluorophenyl)-N-methylethanamine
CID 105032435
1-(2-bromo-4-fluorophenyl)-2-(2,3-dichlorophenyl)-N-ethylethanamine
CID 107309221
1-(5-bromo-2-fluorophenyl)-2-(2-chloro-3-fluorophenyl)-N-methylethanamine
CID 114894692
1-(4-bromo-2-chlorophenyl)-N-methyl-2-(2-methylphenyl)ethanamine
CID 63527757
1-(5-bromo-2-fluorophenyl)-2-(2-chlorophenyl)-N-methylethanamine
CID 55223564
1-(5-bromo-2-chlorophenyl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 115830664
1-(2-bromo-4-methylphenyl)-2-(2,3-dichlorophenyl)ethanol
CID 107307604

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine?
The IUPAC name of 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine (CID 107947209) is 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine.
What is the SMILES notation for 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine?
The canonical SMILES for 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine is CNC(Cc1cccc(Cl)c1Cl)c1ccc(Br)cc1Br.
What is the InChIKey of 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine?
The InChIKey is FUFIOFXBNRQJPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Br2Cl2N/c1-20-14(11-6-5-10(16)8-12(11)17)7-9-3-2-4-13(18)15(9)19/h2-6,8,14,20H,7H2,1H3.
What are the key properties of 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine?
1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine has a molecular weight of 437.99 g/mol, XLogP of 6.02, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-2-(2,3-dichlorophenyl)-N-methylethanamine is sourced from PubChem (CID 107947209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).