N-[5-bromo-2-(methylamino)phenyl]benzamide

C14H13BrN2O — CID 175288167

IUPACN-[5-bromo-2-(methylamino)phenyl]benzamide
SMILESCNc1ccc(Br)cc1NC(=O)c1ccccc1
InChIInChI=1S/C14H13BrN2O/c1-16-12-8-7-11(15)9-13(12)17-14(18)10-5-3-2-4-6-10/h2-9,16H,1H3,(H,17,18)
InChIKeyIUEFZTFTZIIIHR-UHFFFAOYSA-N
MW305.18 g/mol
LogP3.74
Rot. Bonds3

About N-[5-bromo-2-(methylamino)phenyl]benzamide

N-[5-bromo-2-(methylamino)phenyl]benzamide (PubChem CID 175288167) has the molecular formula C14H13BrN2O and a molecular weight of 305.18 g/mol. Its IUPAC name is N-[5-bromo-2-(methylamino)phenyl]benzamide.

Molecular Properties

Compound NameN-[5-bromo-2-(methylamino)phenyl]benzamide
PubChem CID175288167
Molecular FormulaC14H13BrN2O
Molecular Weight305.18 g/mol
Exact Mass304.02
IUPAC NameN-[5-bromo-2-(methylamino)phenyl]benzamide
SMILESCNc1ccc(Br)cc1NC(=O)c1ccccc1
InChIInChI=1S/C14H13BrN2O/c1-16-12-8-7-11(15)9-13(12)17-14(18)10-5-3-2-4-6-10/h2-9,16H,1H3,(H,17,18)
InChIKeyIUEFZTFTZIIIHR-UHFFFAOYSA-N
XLogP3.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.18
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(methylamino)phenyl]benzamide
CID 101444547
N-(4-bromo-2-iodophenyl)benzamide
CID 3321693
N-(4-bromo-2-carbamothioylphenyl)benzamide
CID 82703506
N-[4-fluoro-2-(methylamino)phenyl]benzamide
CID 174747297
[2-[(4-acetamidobenzoyl)amino]-4-bromophenyl]carbamic acid
CID 67418412
N-(5-bromo-2-methylphenyl)benzamide;N-(2-methyl-5-pyrrol-1-ylphenyl)benzamide
CID 158601564
N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide
CID 61375909
4-bromo-N-(4-bromo-2-iodophenyl)benzamide
CID 3934518
N-(2-benzoyl-4-bromophenyl)-4-(dimethylsulfamoyl)benzamide
CID 1356278
N-(2-benzoyl-4-bromophenyl)naphthalene-2-carboxamide
CID 23941186
N-(5-bromo-2-cyanophenyl)-2-(methylamino)benzamide
CID 107799477
N-(2-benzoyl-4-bromophenyl)-3,4-dimethoxybenzamide
CID 21204048

Frequently Asked Questions

What is the IUPAC name of N-[5-bromo-2-(methylamino)phenyl]benzamide?
The IUPAC name of N-[5-bromo-2-(methylamino)phenyl]benzamide (CID 175288167) is N-[5-bromo-2-(methylamino)phenyl]benzamide.
What is the SMILES notation for N-[5-bromo-2-(methylamino)phenyl]benzamide?
The canonical SMILES for N-[5-bromo-2-(methylamino)phenyl]benzamide is CNc1ccc(Br)cc1NC(=O)c1ccccc1.
What is the InChIKey of N-[5-bromo-2-(methylamino)phenyl]benzamide?
The InChIKey is IUEFZTFTZIIIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O/c1-16-12-8-7-11(15)9-13(12)17-14(18)10-5-3-2-4-6-10/h2-9,16H,1H3,(H,17,18).
What are the key properties of N-[5-bromo-2-(methylamino)phenyl]benzamide?
N-[5-bromo-2-(methylamino)phenyl]benzamide has a molecular weight of 305.18 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-bromo-2-(methylamino)phenyl]benzamide is sourced from PubChem (CID 175288167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).