5-bromo-2-methoxy-N-(3-methylphenyl)benzamide

C15H14BrNO2 — CID 880502

IUPAC5-bromo-2-methoxy-N-(3-methylphenyl)benzamide
SMILESCOc1ccc(Br)cc1C(=O)Nc1cccc(C)c1
InChIInChI=1S/C15H14BrNO2/c1-10-4-3-5-12(8-10)17-15(18)13-9-11(16)6-7-14(13)19-2/h3-9H,1-2H3,(H,17,18)
InChIKeyBNFHUDLXTLRZHV-UHFFFAOYSA-N
MW320.19 g/mol
LogP4.02
Rot. Bonds3

About 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide

5-bromo-2-methoxy-N-(3-methylphenyl)benzamide (PubChem CID 880502) has the molecular formula C15H14BrNO2 and a molecular weight of 320.19 g/mol. Its IUPAC name is 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name5-bromo-2-methoxy-N-(3-methylphenyl)benzamide
PubChem CID880502
Molecular FormulaC15H14BrNO2
Molecular Weight320.19 g/mol
Exact Mass319.02
IUPAC Name5-bromo-2-methoxy-N-(3-methylphenyl)benzamide
SMILESCOc1ccc(Br)cc1C(=O)Nc1cccc(C)c1
InChIInChI=1S/C15H14BrNO2/c1-10-4-3-5-12(8-10)17-15(18)13-9-11(16)6-7-14(13)19-2/h3-9H,1-2H3,(H,17,18)
InChIKeyBNFHUDLXTLRZHV-UHFFFAOYSA-N
XLogP4.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Fluorophene
CID 20906
5-Bromo-N-(4-bromophenyl)-2-hydroxybenzamide
CID 14839
Metabromsalan
CID 17404
4,5-Dibromosalicylanilide
CID 90538
N-(4-Methoxyphenyl)-2-hydroxybenzamide
CID 478806
N-(4-ethoxyphenyl)-2-methoxybenzamide
CID 700573
2-bromo-N-(3-methoxyphenyl)benzamide
CID 795409
Benzofurane-7-carboxamide, 2,3-dihydro-5-bromo-N-(3-trifluoromethylphenyl)-
CID 614539
2-methoxy-N-(4-methylphenyl)benzamide
CID 780793
N-(4-Bromophenyl)-4-methoxybenzamide
CID 346051
N-(4-bromophenyl)-2-methoxybenzamide
CID 531916
4'-Bromosalicylanilide
CID 75817

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide?
The IUPAC name of 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide (CID 880502) is 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide?
The canonical SMILES for 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide is COc1ccc(Br)cc1C(=O)Nc1cccc(C)c1.
What is the InChIKey of 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide?
The InChIKey is BNFHUDLXTLRZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO2/c1-10-4-3-5-12(8-10)17-15(18)13-9-11(16)6-7-14(13)19-2/h3-9H,1-2H3,(H,17,18).
What are the key properties of 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide?
5-bromo-2-methoxy-N-(3-methylphenyl)benzamide has a molecular weight of 320.19 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methoxy-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 880502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).