N-(2-bromo-4,5-dimethylphenyl)acetamide

C10H12BrNO — CID 890424

IUPACN-(2-bromo-4,5-dimethylphenyl)acetamide
SMILESCC(=O)Nc1cc(C)c(C)cc1Br
InChIInChI=1S/C10H12BrNO/c1-6-4-9(11)10(5-7(6)2)12-8(3)13/h4-5H,1-3H3,(H,12,13)
InChIKeySUNBHBXAMLHMAE-UHFFFAOYSA-N
MW242.12 g/mol
LogP3.02
Rot. Bonds1

About N-(2-bromo-4,5-dimethylphenyl)acetamide

N-(2-bromo-4,5-dimethylphenyl)acetamide (PubChem CID 890424) has the molecular formula C10H12BrNO and a molecular weight of 242.12 g/mol. Its IUPAC name is N-(2-bromo-4,5-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-bromo-4,5-dimethylphenyl)acetamide
PubChem CID890424
Molecular FormulaC10H12BrNO
Molecular Weight242.12 g/mol
Exact Mass241.01
IUPAC NameN-(2-bromo-4,5-dimethylphenyl)acetamide
SMILESCC(=O)Nc1cc(C)c(C)cc1Br
InChIInChI=1S/C10H12BrNO/c1-6-4-9(11)10(5-7(6)2)12-8(3)13/h4-5H,1-3H3,(H,12,13)
InChIKeySUNBHBXAMLHMAE-UHFFFAOYSA-N
XLogP3.02
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.12
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3',4'-Dimethylacetanilide
CID 75144
Acetamide, N-(2-bromo-4-methylphenyl)-
CID 69200
N-(4-Bromo-2-methylphenyl)acetamide
CID 222277
N-(4-bromo-2-ethylphenyl)acetamide
CID 2735223
(2E)-N-(2-Bromo-4-methylphenyl)-3-phenylprop-2-enamide
CID 774831
N-(2-bromo-4-methylphenyl)-2-cyclopentylacetamide
CID 2707548
4'-Ethyl-3'-methylacetanilide
CID 251682
N-(7-amino-6,8-dibromo-9H-fluoren-2-yl)acetamide
CID 256438
N-(1,3,7-tribromo-9H-fluoren-2-yl)acetamide
CID 267219
N-(2-bromo-4-methylphenyl)cyclopentanecarboxamide
CID 896020
N-(1-Bromo-2-naphthyl)acetamide
CID 228180
4-Acetamido-3-bromobenzotrifluoride
CID 706569

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4,5-dimethylphenyl)acetamide?
The IUPAC name of N-(2-bromo-4,5-dimethylphenyl)acetamide (CID 890424) is N-(2-bromo-4,5-dimethylphenyl)acetamide.
What is the SMILES notation for N-(2-bromo-4,5-dimethylphenyl)acetamide?
The canonical SMILES for N-(2-bromo-4,5-dimethylphenyl)acetamide is CC(=O)Nc1cc(C)c(C)cc1Br.
What is the InChIKey of N-(2-bromo-4,5-dimethylphenyl)acetamide?
The InChIKey is SUNBHBXAMLHMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO/c1-6-4-9(11)10(5-7(6)2)12-8(3)13/h4-5H,1-3H3,(H,12,13).
What are the key properties of N-(2-bromo-4,5-dimethylphenyl)acetamide?
N-(2-bromo-4,5-dimethylphenyl)acetamide has a molecular weight of 242.12 g/mol, XLogP of 3.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4,5-dimethylphenyl)acetamide is sourced from PubChem (CID 890424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).