2-bromo-N-ethyl-N-methylbenzamide

C10H12BrNO — CID 43243486

IUPAC2-bromo-N-ethyl-N-methylbenzamide
SMILESCCN(C)C(=O)c1ccccc1Br
InChIInChI=1S/C10H12BrNO/c1-3-12(2)10(13)8-6-4-5-7-9(8)11/h4-7H,3H2,1-2H3
InChIKeyGFZJQXLQOSXENC-UHFFFAOYSA-N
MW242.12 g/mol
LogP2.54
Rot. Bonds2

About 2-bromo-N-ethyl-N-methylbenzamide

2-bromo-N-ethyl-N-methylbenzamide (PubChem CID 43243486) has the molecular formula C10H12BrNO and a molecular weight of 242.12 g/mol. Its IUPAC name is 2-bromo-N-ethyl-N-methylbenzamide.

Molecular Properties

Compound Name2-bromo-N-ethyl-N-methylbenzamide
PubChem CID43243486
Molecular FormulaC10H12BrNO
Molecular Weight242.12 g/mol
Exact Mass241.01
IUPAC Name2-bromo-N-ethyl-N-methylbenzamide
SMILESCCN(C)C(=O)c1ccccc1Br
InChIInChI=1S/C10H12BrNO/c1-3-12(2)10(13)8-6-4-5-7-9(8)11/h4-7H,3H2,1-2H3
InChIKeyGFZJQXLQOSXENC-UHFFFAOYSA-N
XLogP2.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.12
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-bromo-N-ethyl-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-[(2-bromobenzoyl)-methylamino]acetate
CID 54982790
2-bromo-N-methyl-N-(2-phenylethyl)benzamide
CID 60739770
2-bromo-N-methyl-N-pentan-3-ylbenzamide
CID 43571450
2-bromo-N-methyl-N-[(4-methylphenyl)methyl]benzamide
CID 28799501
N-(2-amino-2-oxoethyl)-2-bromo-N-ethylbenzamide
CID 103102660
2-bromo-N-butyl-N-ethylbenzamide
CID 2164030
2-bromo-N-(2-cyanopropyl)-N-methylbenzamide
CID 55021092
2-bromo-N-methoxy-N-methylbenzamide
CID 46318655
2-bromo-N-tert-butyl-N-methylbenzamide
CID 4597758
2-bromo-N,N-dibutylbenzamide
CID 2843235
2-bromo-N-ethyl-N,6-dimethylbenzamide
CID 130664662
N-(3-amino-4-methylpentyl)-2-bromo-N-methylbenzamide;hydrochloride
CID 119658345

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-ethyl-N-methylbenzamide?
The IUPAC name of 2-bromo-N-ethyl-N-methylbenzamide (CID 43243486) is 2-bromo-N-ethyl-N-methylbenzamide.
What is the SMILES notation for 2-bromo-N-ethyl-N-methylbenzamide?
The canonical SMILES for 2-bromo-N-ethyl-N-methylbenzamide is CCN(C)C(=O)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-ethyl-N-methylbenzamide?
The InChIKey is GFZJQXLQOSXENC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO/c1-3-12(2)10(13)8-6-4-5-7-9(8)11/h4-7H,3H2,1-2H3.
What are the key properties of 2-bromo-N-ethyl-N-methylbenzamide?
2-bromo-N-ethyl-N-methylbenzamide has a molecular weight of 242.12 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-ethyl-N-methylbenzamide is sourced from PubChem (CID 43243486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).