N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide

C14H11BrClNO2 — CID 28532000

IUPACN-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide
SMILESCc1cc(NC(=O)c2cc(Cl)ccc2O)ccc1Br
InChIInChI=1S/C14H11BrClNO2/c1-8-6-10(3-4-12(8)15)17-14(19)11-7-9(16)2-5-13(11)18/h2-7,18H,1H3,(H,17,19)
InChIKeyKAEPBDHJBYGNAG-UHFFFAOYSA-N
MW340.60 g/mol
LogP4.37
Rot. Bonds2

About N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide

N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide (PubChem CID 28532000) has the molecular formula C14H11BrClNO2 and a molecular weight of 340.60 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide
PubChem CID28532000
Molecular FormulaC14H11BrClNO2
Molecular Weight340.60 g/mol
Exact Mass338.97
IUPAC NameN-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide
SMILESCc1cc(NC(=O)c2cc(Cl)ccc2O)ccc1Br
InChIInChI=1S/C14H11BrClNO2/c1-8-6-10(3-4-12(8)15)17-14(19)11-7-9(16)2-5-13(11)18/h2-7,18H,1H3,(H,17,19)
InChIKeyKAEPBDHJBYGNAG-UHFFFAOYSA-N
XLogP4.37
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(4-bromo-3-methylphenyl)-5-chlorobenzamide
CID 113221431
5-bromo-N-(4-bromo-3-methylphenyl)-2-hydroxybenzamide
CID 103602071
N-(3-amino-4-bromophenyl)-5-chloro-2-hydroxybenzamide
CID 79767581
N-(4-bromo-3-methoxyphenyl)-5-chloro-2-hydroxybenzamide
CID 82867994
N-(4-bromo-3-methylphenyl)-5-chloro-2-methoxybenzamide
CID 2198688
N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide
CID 63998623
5-chloro-2-hydroxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 47317877
5-[(5-chloro-2-hydroxybenzoyl)amino]-2-methylbenzoic acid
CID 63653834
N-(4-bromo-3-methylphenyl)-5-chloro-1H-indole-3-carboxamide
CID 113205923
5-chloro-N-(3,5-dichloro-4-methylphenyl)-2-hydroxybenzamide
CID 167679776
N-(4-amino-3-bromophenyl)-5-chloro-2-methylbenzamide
CID 82881267
N-(3-bromo-5-chlorophenyl)-5-chloro-2-hydroxybenzamide
CID 177120584

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide (CID 28532000) is N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide is Cc1cc(NC(=O)c2cc(Cl)ccc2O)ccc1Br.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide?
The InChIKey is KAEPBDHJBYGNAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO2/c1-8-6-10(3-4-12(8)15)17-14(19)11-7-9(16)2-5-13(11)18/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide?
N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide has a molecular weight of 340.60 g/mol, XLogP of 4.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 28532000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).