N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide

C14H10BrCl2NO — CID 3367172

IUPACN-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide
SMILESCc1cc(NC(=O)c2c(Cl)cccc2Cl)ccc1Br
InChIInChI=1S/C14H10BrCl2NO/c1-8-7-9(5-6-10(8)15)18-14(19)13-11(16)3-2-4-12(13)17/h2-7H,1H3,(H,18,19)
InChIKeyBSRAXBRARJJNAH-UHFFFAOYSA-N
MW359.05 g/mol
LogP5.32
Rot. Bonds2

About N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide

N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide (PubChem CID 3367172) has the molecular formula C14H10BrCl2NO and a molecular weight of 359.05 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide
PubChem CID3367172
Molecular FormulaC14H10BrCl2NO
Molecular Weight359.05 g/mol
Exact Mass356.93
IUPAC NameN-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide
SMILESCc1cc(NC(=O)c2c(Cl)cccc2Cl)ccc1Br
InChIInChI=1S/C14H10BrCl2NO/c1-8-7-9(5-6-10(8)15)18-14(19)13-11(16)3-2-4-12(13)17/h2-7H,1H3,(H,18,19)
InChIKeyBSRAXBRARJJNAH-UHFFFAOYSA-N
XLogP5.32
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.05
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide 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

2-amino-N-(4-bromo-3-methylphenyl)-3-chlorobenzamide
CID 115539970
N-(4-bromo-3-methylphenyl)-2,6-difluorobenzamide
CID 2526988
2-amino-N-(3-bromo-4-methylphenyl)-6-chlorobenzamide
CID 63663448
N-(4-bromo-3-methylphenyl)-3-chloro-4-methylbenzamide
CID 2296154
2,6-dichloro-N-(4-methylphenyl)benzamide
CID 5152296
2-bromo-N-(4-bromo-3-methylphenyl)-5-chlorobenzamide
CID 113221431
N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide
CID 82756818
1-(4-bromo-3-methylphenyl)-3-[3-[(4-bromo-3-methylphenyl)carbamoylamino]phenyl]urea
CID 139171111
N-(4-bromo-3-methylphenyl)-4,5-dichloro-1H-pyrrole-2-carboxamide
CID 31302300
2-bromo-N-(4-bromo-3-methylphenyl)benzamide
CID 2505928
N-(4-bromo-3-methylphenyl)thiophene-2-carboxamide
CID 743467
N-(3-bromo-4-methylphenyl)-3-chloro-2-methylbenzamide
CID 107096907

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide (CID 3367172) is N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide is Cc1cc(NC(=O)c2c(Cl)cccc2Cl)ccc1Br.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide?
The InChIKey is BSRAXBRARJJNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2NO/c1-8-7-9(5-6-10(8)15)18-14(19)13-11(16)3-2-4-12(13)17/h2-7H,1H3,(H,18,19).
What are the key properties of N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide?
N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide has a molecular weight of 359.05 g/mol, XLogP of 5.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide is sourced from PubChem (CID 3367172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).