N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide

C14H10BrCl2NO — CID 82756818

IUPACN-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide
SMILESCc1ccc(Br)c(NC(=O)c2c(Cl)cccc2Cl)c1
InChIInChI=1S/C14H10BrCl2NO/c1-8-5-6-9(15)12(7-8)18-14(19)13-10(16)3-2-4-11(13)17/h2-7H,1H3,(H,18,19)
InChIKeyKOQJBHAGUDZAPD-UHFFFAOYSA-N
MW359.05 g/mol
LogP5.32
Rot. Bonds2

About N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide

N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide (PubChem CID 82756818) has the molecular formula C14H10BrCl2NO and a molecular weight of 359.05 g/mol. Its IUPAC name is N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide.

Molecular Properties

Compound NameN-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide
PubChem CID82756818
Molecular FormulaC14H10BrCl2NO
Molecular Weight359.05 g/mol
Exact Mass356.93
IUPAC NameN-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide
SMILESCc1ccc(Br)c(NC(=O)c2c(Cl)cccc2Cl)c1
InChIInChI=1S/C14H10BrCl2NO/c1-8-5-6-9(15)12(7-8)18-14(19)13-10(16)3-2-4-11(13)17/h2-7H,1H3,(H,18,19)
InChIKeyKOQJBHAGUDZAPD-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

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Related Compounds

N-(2-bromo-5-methylphenyl)-2,6-dimethylbenzamide
CID 113341710
2,6-dichloro-N-(2,5-dimethylphenyl)benzamide
CID 3534518
N-(4-bromo-3-methylphenyl)-2,6-dichlorobenzamide
CID 3367172
N-(2-chloro-5-methylphenyl)-2,6-dihydroxybenzamide
CID 107689718
2,6-dichloro-N-(4-methylphenyl)benzamide
CID 5152296
3-amino-N-(2-bromo-5-methylphenyl)benzamide
CID 82761550
N-(2-bromo-5-methylphenyl)-2-iodo-3-methylbenzamide
CID 103867045
5-amino-N-(2-bromo-5-methylphenyl)-2,3-dichlorobenzamide
CID 107185700
N-(2-bromo-5-chloro-4-methylphenyl)-2-chloro-6-fluorobenzamide
CID 104724195
2-bromo-N-(2-chloro-4-methylphenyl)-6-fluorobenzamide
CID 115678082
2-bromo-N-(2-bromo-5-chlorophenyl)-5-methylbenzamide
CID 81270262
N-(2-bromo-5-methylphenyl)-5-chloro-1,3,4-thiadiazole-2-carboxamide
CID 82757101

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide?
The IUPAC name of N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide (CID 82756818) is N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide.
What is the SMILES notation for N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide?
The canonical SMILES for N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide is Cc1ccc(Br)c(NC(=O)c2c(Cl)cccc2Cl)c1.
What is the InChIKey of N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide?
The InChIKey is KOQJBHAGUDZAPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2NO/c1-8-5-6-9(15)12(7-8)18-14(19)13-10(16)3-2-4-11(13)17/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide?
N-(2-bromo-5-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-(2-bromo-5-methylphenyl)-2,6-dichlorobenzamide is sourced from PubChem (CID 82756818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).