5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide

C14H11BrClNO2 — CID 1121307

IUPAC5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
SMILESCOc1ccc(Br)cc1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H11BrClNO2/c1-19-13-7-6-9(15)8-10(13)14(18)17-12-5-3-2-4-11(12)16/h2-8H,1H3,(H,17,18)
InChIKeyGYHOXOUPODKBCE-UHFFFAOYSA-N
MW340.60 g/mol
LogP4.36
Rot. Bonds3

About 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide

5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide (PubChem CID 1121307) has the molecular formula C14H11BrClNO2 and a molecular weight of 340.60 g/mol. Its IUPAC name is 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
PubChem CID1121307
Molecular FormulaC14H11BrClNO2
Molecular Weight340.60 g/mol
Exact Mass338.97
IUPAC Name5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
SMILESCOc1ccc(Br)cc1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H11BrClNO2/c1-19-13-7-6-9(15)8-10(13)14(18)17-12-5-3-2-4-11(12)16/h2-8H,1H3,(H,17,18)
InChIKeyGYHOXOUPODKBCE-UHFFFAOYSA-N
XLogP4.36
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide?
The IUPAC name of 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide (CID 1121307) is 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide.
What is the SMILES notation for 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide?
The canonical SMILES for 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide is COc1ccc(Br)cc1C(=O)Nc1ccccc1Cl.
What is the InChIKey of 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide?
The InChIKey is GYHOXOUPODKBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO2/c1-19-13-7-6-9(15)8-10(13)14(18)17-12-5-3-2-4-11(12)16/h2-8H,1H3,(H,17,18).
What are the key properties of 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide?
5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide has a molecular weight of 340.60 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide is sourced from PubChem (CID 1121307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).