N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide

C15H14BrClN2O — CID 107578575

IUPACN-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide
SMILESCNc1ccc(Cl)cc1C(=O)Nc1cc(C)cc(Br)c1
InChIInChI=1S/C15H14BrClN2O/c1-9-5-10(16)7-12(6-9)19-15(20)13-8-11(17)3-4-14(13)18-2/h3-8,18H,1-2H3,(H,19,20)
InChIKeyWFLJUNYEAAICSM-UHFFFAOYSA-N
MW353.65 g/mol
LogP4.70
Rot. Bonds3

About N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide

N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide (PubChem CID 107578575) has the molecular formula C15H14BrClN2O and a molecular weight of 353.65 g/mol. Its IUPAC name is N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide
PubChem CID107578575
Molecular FormulaC15H14BrClN2O
Molecular Weight353.65 g/mol
Exact Mass352.00
IUPAC NameN-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide
SMILESCNc1ccc(Cl)cc1C(=O)Nc1cc(C)cc(Br)c1
InChIInChI=1S/C15H14BrClN2O/c1-9-5-10(16)7-12(6-9)19-15(20)13-8-11(17)3-4-14(13)18-2/h3-8,18H,1-2H3,(H,19,20)
InChIKeyWFLJUNYEAAICSM-UHFFFAOYSA-N
XLogP4.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.65
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(3,5-dimethylphenyl)-2-(methylamino)benzamide
CID 62165706
N-(3-bromo-5-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 107578496
N-(3-bromo-5-methylphenyl)-5-chloro-2-(ethylamino)benzamide
CID 107578576
2,5-dichloro-N-(3,5-dimethylphenyl)benzamide
CID 965625
N-(4-bromo-2,6-dichlorophenyl)-5-methyl-2-(methylamino)benzamide
CID 62511408
N-(3-fluoro-5-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 79046553
5-chloro-N-(4-cyanophenyl)-2-(methylamino)benzamide
CID 62166046
N-(3-bromo-5-methylphenyl)-2-fluoro-4-methylbenzamide
CID 107582986
N-(5-bromo-2-cyanophenyl)-5-chloro-2-(methylamino)benzamide
CID 107801239
N-(3-bromo-5-chlorophenyl)-5-chloro-2-hydroxybenzamide
CID 177120584
N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide
CID 142083529
5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide
CID 62236027

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide?
The IUPAC name of N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide (CID 107578575) is N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide.
What is the SMILES notation for N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide?
The canonical SMILES for N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide is CNc1ccc(Cl)cc1C(=O)Nc1cc(C)cc(Br)c1.
What is the InChIKey of N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide?
The InChIKey is WFLJUNYEAAICSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O/c1-9-5-10(16)7-12(6-9)19-15(20)13-8-11(17)3-4-14(13)18-2/h3-8,18H,1-2H3,(H,19,20).
What are the key properties of N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide?
N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide has a molecular weight of 353.65 g/mol, XLogP of 4.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide is sourced from PubChem (CID 107578575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).