5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide

C15H13BrClNO3 — CID 68602584

IUPAC5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide
SMILESCOc1ccccc1N(C)C(=O)c1cc(Br)c(Cl)cc1O
InChIInChI=1S/C15H13BrClNO3/c1-18(12-5-3-4-6-14(12)21-2)15(20)9-7-10(16)11(17)8-13(9)19/h3-8,19H,1-2H3
InChIKeyXOAHMCKPEJRFTF-UHFFFAOYSA-N
MW370.63 g/mol
LogP4.09
Rot. Bonds3

About 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide

5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide (PubChem CID 68602584) has the molecular formula C15H13BrClNO3 and a molecular weight of 370.63 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide.

Molecular Properties

Compound Name5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide
PubChem CID68602584
Molecular FormulaC15H13BrClNO3
Molecular Weight370.63 g/mol
Exact Mass368.98
IUPAC Name5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide
SMILESCOc1ccccc1N(C)C(=O)c1cc(Br)c(Cl)cc1O
InChIInChI=1S/C15H13BrClNO3/c1-18(12-5-3-4-6-14(12)21-2)15(20)9-7-10(16)11(17)8-13(9)19/h3-8,19H,1-2H3
InChIKeyXOAHMCKPEJRFTF-UHFFFAOYSA-N
XLogP4.09
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.63
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-trimethylsilylethyl 2-[4-bromo-5-chloro-2-[(2-methoxyphenyl)-methylcarbamoyl]phenyl]acetate
CID 68602979
2-chloro-N-(2-methoxyphenyl)-N-methyl-5-sulfanylbenzamide
CID 107027609
2-bromo-N-(2-methoxyphenyl)-N-methyl-5-sulfanylbenzamide
CID 107027611
3,5-dibromo-N-(2-methoxyphenyl)-N-methylbenzamide
CID 103908080
2-bromo-N-(2-methoxyphenyl)-N,3-dimethylbenzamide
CID 103853420
2-chloro-N-(2-hydroxyphenyl)-N-methylbenzamide
CID 141220013
N-(2-amino-5-chlorophenyl)-2-methoxy-N-methylbenzamide
CID 107465525
5-bromo-N-(2-methoxyphenyl)-N,4-dimethylthiophene-2-carboxamide
CID 79926894
3-chloro-6-hydrazinyl-N-(2-methoxyphenyl)-N-methylpyridine-2-carboxamide
CID 62249084
N-(2-methoxyphenyl)-N-methyl-3-sulfanylbenzamide
CID 107027620
3-amino-N-(2-methoxyphenyl)-N-methylpropanamide
CID 28795107
methyl 5-bromo-4-chloro-2-methoxybenzoate
CID 26370082

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide?
The IUPAC name of 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide (CID 68602584) is 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide.
What is the SMILES notation for 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide?
The canonical SMILES for 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide is COc1ccccc1N(C)C(=O)c1cc(Br)c(Cl)cc1O.
What is the InChIKey of 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide?
The InChIKey is XOAHMCKPEJRFTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClNO3/c1-18(12-5-3-4-6-14(12)21-2)15(20)9-7-10(16)11(17)8-13(9)19/h3-8,19H,1-2H3.
What are the key properties of 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide?
5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide has a molecular weight of 370.63 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-hydroxy-N-(2-methoxyphenyl)-N-methylbenzamide is sourced from PubChem (CID 68602584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).