N-(5-bromo-4-methoxy-2-methylphenyl)acetamide

C10H12BrNO2 — CID 66766852

IUPACN-(5-bromo-4-methoxy-2-methylphenyl)acetamide
SMILESCOc1cc(C)c(NC(C)=O)cc1Br
InChIInChI=1S/C10H12BrNO2/c1-6-4-10(14-3)8(11)5-9(6)12-7(2)13/h4-5H,1-3H3,(H,12,13)
InChIKeyPNZHTGLCLCATLF-UHFFFAOYSA-N
MW258.11 g/mol
LogP2.72
Rot. Bonds2

About N-(5-bromo-4-methoxy-2-methylphenyl)acetamide

N-(5-bromo-4-methoxy-2-methylphenyl)acetamide (PubChem CID 66766852) has the molecular formula C10H12BrNO2 and a molecular weight of 258.11 g/mol. Its IUPAC name is N-(5-bromo-4-methoxy-2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-4-methoxy-2-methylphenyl)acetamide
PubChem CID66766852
Molecular FormulaC10H12BrNO2
Molecular Weight258.11 g/mol
Exact Mass257.01
IUPAC NameN-(5-bromo-4-methoxy-2-methylphenyl)acetamide
SMILESCOc1cc(C)c(NC(C)=O)cc1Br
InChIInChI=1S/C10H12BrNO2/c1-6-4-10(14-3)8(11)5-9(6)12-7(2)13/h4-5H,1-3H3,(H,12,13)
InChIKeyPNZHTGLCLCATLF-UHFFFAOYSA-N
XLogP2.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.11
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-4-chloro-2-methoxyphenyl)acetamide
CID 171363899
3-acetamido-N-(4,5-dimethoxy-2-methylphenyl)-4-methylbenzamide
CID 46489735
(2R)-2-(2-bromo-4-methylphenoxy)-N-(4,5-dimethoxy-2-methylphenyl)propanamide
CID 51958225
(4,5-dimethoxy-2-methylphenyl)urea
CID 82492626
N-(3-bromo-4-methoxy-2,6-dimethylphenyl)acetamide
CID 155615406
5-bromo-4-methoxy-2-methylbenzoyl chloride
CID 156551908
N-(5-bromo-2-methoxy-4-nitrophenyl)acetamide
CID 71409389
N-(2,4,5-trimethoxyphenyl)acetamide
CID 54074808
1-(4-methoxy-2,5-dimethylphenyl)-3-methylurea
CID 115168877
1-(4,5-dimethoxy-2-methylanilino)propan-2-one
CID 115234469
N-(4-acetamido-3-methylphenyl)-3-(3-bromo-4-methoxyphenyl)propanamide
CID 38016381
N-[5-methoxy-2-methyl-4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 123287218

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-methoxy-2-methylphenyl)acetamide?
The IUPAC name of N-(5-bromo-4-methoxy-2-methylphenyl)acetamide (CID 66766852) is N-(5-bromo-4-methoxy-2-methylphenyl)acetamide.
What is the SMILES notation for N-(5-bromo-4-methoxy-2-methylphenyl)acetamide?
The canonical SMILES for N-(5-bromo-4-methoxy-2-methylphenyl)acetamide is COc1cc(C)c(NC(C)=O)cc1Br.
What is the InChIKey of N-(5-bromo-4-methoxy-2-methylphenyl)acetamide?
The InChIKey is PNZHTGLCLCATLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO2/c1-6-4-10(14-3)8(11)5-9(6)12-7(2)13/h4-5H,1-3H3,(H,12,13).
What are the key properties of N-(5-bromo-4-methoxy-2-methylphenyl)acetamide?
N-(5-bromo-4-methoxy-2-methylphenyl)acetamide has a molecular weight of 258.11 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-methoxy-2-methylphenyl)acetamide is sourced from PubChem (CID 66766852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).