1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine

C15H16Br2N2 — CID 66481166

IUPAC1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine
SMILESCc1cc(C(CN)Nc2ccc(Br)cc2)ccc1Br
InChIInChI=1S/C15H16Br2N2/c1-10-8-11(2-7-14(10)17)15(9-18)19-13-5-3-12(16)4-6-13/h2-8,15,19H,9,18H2,1H3
InChIKeyYBLQIQNMWNOUAZ-UHFFFAOYSA-N
MW384.12 g/mol
LogP4.63
Rot. Bonds4

About 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine

1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine (PubChem CID 66481166) has the molecular formula C15H16Br2N2 and a molecular weight of 384.12 g/mol. Its IUPAC name is 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine
PubChem CID66481166
Molecular FormulaC15H16Br2N2
Molecular Weight384.12 g/mol
Exact Mass381.97
IUPAC Name1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine
SMILESCc1cc(C(CN)Nc2ccc(Br)cc2)ccc1Br
InChIInChI=1S/C15H16Br2N2/c1-10-8-11(2-7-14(10)17)15(9-18)19-13-5-3-12(16)4-6-13/h2-8,15,19H,9,18H2,1H3
InChIKeyYBLQIQNMWNOUAZ-UHFFFAOYSA-N
XLogP4.63
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.12
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine 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-(3-bromo-4-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine
CID 105405065
1-(4-bromo-3-fluorophenyl)-N-(4-bromophenyl)ethane-1,2-diamine
CID 81437083
N-(4-bromophenyl)-1-(3,4-dimethoxyphenyl)ethane-1,2-diamine
CID 65377060
1-(3,4-dimethylphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 65377760
N-(3-bromo-5-methylphenyl)-1-(4-bromophenyl)ethane-1,2-diamine
CID 107582913
1-(4-bromophenyl)-N-(4-methoxyphenyl)ethane-1,2-diamine
CID 65385796
1-(4-bromo-3-methylphenyl)-N-cyclopropylethane-1,2-diamine
CID 66475041
1-(4-bromo-3-fluorophenyl)-N-(4-chlorophenyl)ethane-1,2-diamine
CID 81436862
1-(3-bromophenyl)-N-(3-chloro-4-methylphenyl)ethane-1,2-diamine
CID 104721910
N-(2-bromo-5-methylphenyl)-1-(3,4-dimethylphenyl)ethane-1,2-diamine
CID 82756921
N-(4-bromophenyl)-1-(3-methylthiophen-2-yl)ethane-1,2-diamine
CID 65385553
1-(3-chloro-4-methylphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 106817471

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine?
The IUPAC name of 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine (CID 66481166) is 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine.
What is the SMILES notation for 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine?
The canonical SMILES for 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine is Cc1cc(C(CN)Nc2ccc(Br)cc2)ccc1Br.
What is the InChIKey of 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine?
The InChIKey is YBLQIQNMWNOUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Br2N2/c1-10-8-11(2-7-14(10)17)15(9-18)19-13-5-3-12(16)4-6-13/h2-8,15,19H,9,18H2,1H3.
What are the key properties of 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine?
1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine has a molecular weight of 384.12 g/mol, XLogP of 4.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-3-methylphenyl)-N-(4-bromophenyl)ethane-1,2-diamine is sourced from PubChem (CID 66481166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).