4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide

C15H14BrClN2O — CID 55336483

IUPAC4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
SMILESCN(C)c1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1
InChIInChI=1S/C15H14BrClN2O/c1-19(2)14-8-7-12(17)9-13(14)18-15(20)10-3-5-11(16)6-4-10/h3-9H,1-2H3,(H,18,20)
InChIKeyRFJHKBDZWRHXJM-UHFFFAOYSA-N
MW353.65 g/mol
LogP4.42
Rot. Bonds3

About 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide

4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide (PubChem CID 55336483) has the molecular formula C15H14BrClN2O and a molecular weight of 353.65 g/mol. Its IUPAC name is 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide.

Molecular Properties

Compound Name4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
PubChem CID55336483
Molecular FormulaC15H14BrClN2O
Molecular Weight353.65 g/mol
Exact Mass352.00
IUPAC Name4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
SMILESCN(C)c1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1
InChIInChI=1S/C15H14BrClN2O/c1-19(2)14-8-7-12(17)9-13(14)18-15(20)10-3-5-11(16)6-4-10/h3-9H,1-2H3,(H,18,20)
InChIKeyRFJHKBDZWRHXJM-UHFFFAOYSA-N
XLogP4.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.65
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
CID 107812913
4-(aminomethyl)-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
CID 43710258
4-bromo-N-(2,5-dichlorophenyl)benzamide
CID 763593
N-[5-chloro-2-(dimethylamino)phenyl]-6-oxo-1H-pyridine-3-carboxamide
CID 60630528
4-bromo-N-[2-(dimethylamino)phenyl]benzamide
CID 30875552
N-[5-chloro-2-(dimethylamino)phenyl]-3-methylbenzamide
CID 55336201
4-bromo-N-[5-bromo-2-(dimethylamino)phenyl]-3-fluorobenzamide
CID 63526166
5-bromo-N-[5-chloro-2-(dimethylamino)phenyl]thiophene-2-carboxamide
CID 55336457
N-[5-chloro-2-(dimethylamino)phenyl]-3-fluoro-4-methoxybenzamide
CID 78807126
N-[5-chloro-2-(dimethylamino)phenyl]-4-pyrazol-1-ylbenzamide
CID 55369232
N-[5-chloro-2-(dimethylamino)phenyl]-2-fluoropyridine-4-carboxamide
CID 60565434
2-amino-4-chloro-N-[5-chloro-2-(dimethylamino)phenyl]benzamide
CID 63110506

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide?
The IUPAC name of 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide (CID 55336483) is 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide.
What is the SMILES notation for 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide?
The canonical SMILES for 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide is CN(C)c1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide?
The InChIKey is RFJHKBDZWRHXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O/c1-19(2)14-8-7-12(17)9-13(14)18-15(20)10-3-5-11(16)6-4-10/h3-9H,1-2H3,(H,18,20).
What are the key properties of 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide?
4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide has a molecular weight of 353.65 g/mol, XLogP of 4.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-[5-chloro-2-(dimethylamino)phenyl]benzamide is sourced from PubChem (CID 55336483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).