5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide

C15H13BrClNO2 — CID 2529315

IUPAC5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide
SMILESCOc1ccc(C)cc1NC(=O)c1cc(Br)ccc1Cl
InChIInChI=1S/C15H13BrClNO2/c1-9-3-6-14(20-2)13(7-9)18-15(19)11-8-10(16)4-5-12(11)17/h3-8H,1-2H3,(H,18,19)
InChIKeyLUABLFLWQRSBPJ-UHFFFAOYSA-N
MW354.63 g/mol
LogP4.67
Rot. Bonds3

About 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide

5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide (PubChem CID 2529315) has the molecular formula C15H13BrClNO2 and a molecular weight of 354.63 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide.

Molecular Properties

Compound Name5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide
PubChem CID2529315
Molecular FormulaC15H13BrClNO2
Molecular Weight354.63 g/mol
Exact Mass352.98
IUPAC Name5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide
SMILESCOc1ccc(C)cc1NC(=O)c1cc(Br)ccc1Cl
InChIInChI=1S/C15H13BrClNO2/c1-9-3-6-14(20-2)13(7-9)18-15(19)11-8-10(16)4-5-12(11)17/h3-8H,1-2H3,(H,18,19)
InChIKeyLUABLFLWQRSBPJ-UHFFFAOYSA-N
XLogP4.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.63
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-[3-[(5-bromo-2-chlorobenzoyl)amino]-4-methoxyphenyl]-2-chlorobenzamide
CID 3910940
2,5-dichloro-N-(2-methoxy-5-methylphenyl)benzamide
CID 965623
2,4-dibromo-N-(2-methoxy-5-methylphenyl)benzamide
CID 103882118
N-(4-bromo-2-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 34054741
2-bromo-N-(5-bromo-2-methoxyphenyl)-5-methylbenzamide
CID 80974126
N-(5-bromo-2-methoxyphenyl)-2-fluoro-5-methylbenzamide
CID 62515870
5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
CID 1121307
5-bromo-2-chloro-N-(2,4-dibromo-5-methoxyphenyl)benzamide
CID 103414514
4-bromo-2-chloro-N-(2,5-dimethoxyphenyl)benzamide
CID 55883648
2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 33169745
4-bromo-N-(5-bromo-2-methoxyphenyl)-2-methoxybenzamide
CID 78987917
4-bromo-N-(5-bromo-2-chlorophenyl)-2-methoxybenzamide
CID 78920099

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide?
The IUPAC name of 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide (CID 2529315) is 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide.
What is the SMILES notation for 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide?
The canonical SMILES for 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide is COc1ccc(C)cc1NC(=O)c1cc(Br)ccc1Cl.
What is the InChIKey of 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide?
The InChIKey is LUABLFLWQRSBPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClNO2/c1-9-3-6-14(20-2)13(7-9)18-15(19)11-8-10(16)4-5-12(11)17/h3-8H,1-2H3,(H,18,19).
What are the key properties of 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide?
5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide has a molecular weight of 354.63 g/mol, XLogP of 4.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide is sourced from PubChem (CID 2529315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).