2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide

C14H10Br2ClNO — CID 81270262

IUPAC2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide
SMILESCc1ccc(Br)c(C(=O)Nc2cc(Cl)ccc2Br)c1
InChIInChI=1S/C14H10Br2ClNO/c1-8-2-4-11(15)10(6-8)14(19)18-13-7-9(17)3-5-12(13)16/h2-7H,1H3,(H,18,19)
InChIKeyFKGIIAAFUDPSQN-UHFFFAOYSA-N
MW403.50 g/mol
LogP5.43
Rot. Bonds2

About 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide

2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide (PubChem CID 81270262) has the molecular formula C14H10Br2ClNO and a molecular weight of 403.50 g/mol. Its IUPAC name is 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide.

Molecular Properties

Compound Name2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide
PubChem CID81270262
Molecular FormulaC14H10Br2ClNO
Molecular Weight403.50 g/mol
Exact Mass400.88
IUPAC Name2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide
SMILESCc1ccc(Br)c(C(=O)Nc2cc(Cl)ccc2Br)c1
InChIInChI=1S/C14H10Br2ClNO/c1-8-2-4-11(15)10(6-8)14(19)18-13-7-9(17)3-5-12(13)16/h2-7H,1H3,(H,18,19)
InChIKeyFKGIIAAFUDPSQN-UHFFFAOYSA-N
XLogP5.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.50
LogP ≤ 55.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromo-5-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 81272413
2-bromo-N-(4-chloro-2-fluorophenyl)-5-methylbenzamide
CID 80948575
N-(2-amino-4-chlorophenyl)-2-bromo-5-methylbenzamide
CID 81109928
N-(2-bromo-5-chlorophenyl)-4-methyl-2-(methylamino)benzamide
CID 81275377
2-bromo-N-(2-carbamothioyl-5-chlorophenyl)-5-methylbenzamide
CID 81110952
N-(2-bromo-5-methylphenyl)-5-chloro-2-methoxybenzamide
CID 82707312
2-bromo-N-(3,5-dichlorophenyl)-5-methylbenzamide
CID 81110211
N-(2-bromo-5-chlorophenyl)-3-hydroxy-2-methylbenzamide
CID 82829711
N-(2-bromo-5-chlorophenyl)-2-methylfuran-3-carboxamide
CID 81271612
2-amino-N-(2-bromo-4-chlorophenyl)-5-methylbenzamide
CID 81262086
2,4-dibromo-N-(2-bromo-5-chlorophenyl)benzamide
CID 114018389
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide?
The IUPAC name of 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide (CID 81270262) is 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide.
What is the SMILES notation for 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide?
The canonical SMILES for 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide is Cc1ccc(Br)c(C(=O)Nc2cc(Cl)ccc2Br)c1.
What is the InChIKey of 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide?
The InChIKey is FKGIIAAFUDPSQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2ClNO/c1-8-2-4-11(15)10(6-8)14(19)18-13-7-9(17)3-5-12(13)16/h2-7H,1H3,(H,18,19).
What are the key properties of 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide?
2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide has a molecular weight of 403.50 g/mol, XLogP of 5.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide is sourced from PubChem (CID 81270262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).