3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide

C10H8Br2F3NO — CID 103908249

IUPAC3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
SMILESCN(CC(F)(F)F)C(=O)c1cc(Br)cc(Br)c1
InChIInChI=1S/C10H8Br2F3NO/c1-16(5-10(13,14)15)9(17)6-2-7(11)4-8(12)3-6/h2-4H,5H2,1H3
InChIKeyJHJGWEYSKWGBRU-UHFFFAOYSA-N
MW374.98 g/mol
LogP3.85
Rot. Bonds2

About 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide

3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide (PubChem CID 103908249) has the molecular formula C10H8Br2F3NO and a molecular weight of 374.98 g/mol. Its IUPAC name is 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide.

Molecular Properties

Compound Name3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
PubChem CID103908249
Molecular FormulaC10H8Br2F3NO
Molecular Weight374.98 g/mol
Exact Mass372.89
IUPAC Name3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
SMILESCN(CC(F)(F)F)C(=O)c1cc(Br)cc(Br)c1
InChIInChI=1S/C10H8Br2F3NO/c1-16(5-10(13,14)15)9(17)6-2-7(11)4-8(12)3-6/h2-4H,5H2,1H3
InChIKeyJHJGWEYSKWGBRU-UHFFFAOYSA-N
XLogP3.85
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.98
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide 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

4-bromo-3-chloro-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 80975840
4-ethyl-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 69057682
3-bromo-N-ethyl-5-fluoro-N-(2,2,2-trifluoroethyl)benzamide
CID 78883881
4-amino-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 60892887
3-amino-5-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 81089871
3-hydroxy-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 60891416
3,5-dibromo-N-(2-chloropropyl)-N-methylbenzamide
CID 107974799
3-bromo-N-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]benzamide
CID 52599948
N-(3-amino-2,2-dimethylpropyl)-3-bromo-5-chloro-N-methylbenzamide
CID 114018521
3,5-dibromo-N-(2-ethoxyethyl)-N-methylbenzamide
CID 103909435
3-(chloromethyl)-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 60893102
4-amino-N-methyl-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)benzamide
CID 62161986

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide?
The IUPAC name of 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide (CID 103908249) is 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide.
What is the SMILES notation for 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide?
The canonical SMILES for 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide is CN(CC(F)(F)F)C(=O)c1cc(Br)cc(Br)c1.
What is the InChIKey of 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide?
The InChIKey is JHJGWEYSKWGBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Br2F3NO/c1-16(5-10(13,14)15)9(17)6-2-7(11)4-8(12)3-6/h2-4H,5H2,1H3.
What are the key properties of 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide?
3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide has a molecular weight of 374.98 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-methyl-N-(2,2,2-trifluoroethyl)benzamide is sourced from PubChem (CID 103908249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).