N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide

C15H12Br2N2O2 — CID 108531900

IUPACN-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide
SMILESCc1cc(Br)ccc1NC(=O)C(=O)Nc1ccccc1Br
InChIInChI=1S/C15H12Br2N2O2/c1-9-8-10(16)6-7-12(9)18-14(20)15(21)19-13-5-3-2-4-11(13)17/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKeyQQDSQGIAQKMRJK-UHFFFAOYSA-N
MW412.08 g/mol
LogP4.10
Rot. Bonds2

About N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide

N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide (PubChem CID 108531900) has the molecular formula C15H12Br2N2O2 and a molecular weight of 412.08 g/mol. Its IUPAC name is N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide.

Molecular Properties

Compound NameN-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide
PubChem CID108531900
Molecular FormulaC15H12Br2N2O2
Molecular Weight412.08 g/mol
Exact Mass409.93
IUPAC NameN-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide
SMILESCc1cc(Br)ccc1NC(=O)C(=O)Nc1ccccc1Br
InChIInChI=1S/C15H12Br2N2O2/c1-9-8-10(16)6-7-12(9)18-14(20)15(21)19-13-5-3-2-4-11(13)17/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKeyQQDSQGIAQKMRJK-UHFFFAOYSA-N
XLogP4.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.08
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

1-(4-bromo-2-methylphenyl)-3-(2-methylphenyl)urea
CID 108894214
N'-(4-bromo-2-methylphenyl)-N-(4-bromo-3-methylphenyl)oxamide
CID 108532618
N-(2-bromophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512305
N'-(3-acetamidophenyl)-N-(4-bromo-2-methylphenyl)oxamide
CID 108526648
N'-(2-bromophenyl)-N-(2,4-dimethylphenyl)propanediamide
CID 108953507
N-(4-bromo-2-methylphenyl)-N'-[3-(trifluoromethyl)phenyl]oxamide
CID 108501480
N'-(4-amino-2-chlorophenyl)-N-(4-bromo-2-methylphenyl)oxamide
CID 108516290
N'-(4-bromo-2-methylphenyl)-N-(4-methoxyphenyl)oxamide
CID 108502691
1-(4-bromo-2-ethylphenyl)-3-(2-bromophenyl)urea
CID 17217802
N-(4-bromo-2-methylphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 108515633
5-bromo-N-(4-bromo-2-methylphenyl)naphthalene-1-carboxamide
CID 3475796
methyl 4-[[2-(4-bromo-2-methylanilino)-2-oxoacetyl]amino]benzoate
CID 108528189

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide?
The IUPAC name of N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide (CID 108531900) is N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide.
What is the SMILES notation for N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide?
The canonical SMILES for N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide is Cc1cc(Br)ccc1NC(=O)C(=O)Nc1ccccc1Br.
What is the InChIKey of N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide?
The InChIKey is QQDSQGIAQKMRJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Br2N2O2/c1-9-8-10(16)6-7-12(9)18-14(20)15(21)19-13-5-3-2-4-11(13)17/h2-8H,1H3,(H,18,20)(H,19,21).
What are the key properties of N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide?
N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide has a molecular weight of 412.08 g/mol, XLogP of 4.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-methylphenyl)-N'-(2-bromophenyl)oxamide is sourced from PubChem (CID 108531900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).