2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide

C11H12Br3NO2 — CID 103028807

IUPAC2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide
SMILESCOC(C)(C)C(=O)Nc1c(Br)cc(Br)cc1Br
InChIInChI=1S/C11H12Br3NO2/c1-11(2,17-3)10(16)15-9-7(13)4-6(12)5-8(9)14/h4-5H,1-3H3,(H,15,16)
InChIKeyDMBGIIAXMMVNPH-UHFFFAOYSA-N
MW429.93 g/mol
LogP4.34
Rot. Bonds3

About 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide

2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide (PubChem CID 103028807) has the molecular formula C11H12Br3NO2 and a molecular weight of 429.93 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide
PubChem CID103028807
Molecular FormulaC11H12Br3NO2
Molecular Weight429.93 g/mol
Exact Mass426.84
IUPAC Name2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide
SMILESCOC(C)(C)C(=O)Nc1c(Br)cc(Br)cc1Br
InChIInChI=1S/C11H12Br3NO2/c1-11(2,17-3)10(16)15-9-7(13)4-6(12)5-8(9)14/h4-5H,1-3H3,(H,15,16)
InChIKeyDMBGIIAXMMVNPH-UHFFFAOYSA-N
XLogP4.34
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.93
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-2,6-dimethylphenyl)-2-methoxy-2-methylpropanamide
CID 103020703
N-(3-bromo-5-methylphenyl)-2-methoxy-2-methylpropanamide
CID 104938678
2-amino-2-methyl-N-(2,4,6-tribromophenyl)pentanamide
CID 54928689
N,N'-bis(2,4,6-tribromophenyl)oxamide
CID 89438715
N-[3-bromo-5-(trifluoromethyl)phenyl]-2-methoxy-2-methylpropanamide
CID 103708561
N-(2,6-dibromo-4-methylphenyl)-2,2-dimethylpropanamide
CID 60629516
2-methyl-2-piperazin-1-yl-N-(2,4,6-tribromophenyl)propanamide
CID 80547446
2-methyl-2-[(2,4,6-tribromophenyl)carbamoylamino]propanoic acid
CID 61266732
(2,4,6-tribromophenyl)urea
CID 28991940
N-[2,4-dibromo-6-[3,5-dibromo-2-[(2,2,2-trifluoroacetyl)amino]phenyl]phenyl]-2,2,2-trifluoroacetamide
CID 11331444
methyl 3,5-dibromo-2-[(3-hydroxy-2,2-dimethylpropyl)amino]benzoate
CID 81412150
N-(4-bromo-2-cyanophenyl)-2-methoxy-2-methylpropanamide
CID 103020238

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide (CID 103028807) is 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide is COC(C)(C)C(=O)Nc1c(Br)cc(Br)cc1Br.
What is the InChIKey of 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide?
The InChIKey is DMBGIIAXMMVNPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Br3NO2/c1-11(2,17-3)10(16)15-9-7(13)4-6(12)5-8(9)14/h4-5H,1-3H3,(H,15,16).
What are the key properties of 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide?
2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide has a molecular weight of 429.93 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-(2,4,6-tribromophenyl)propanamide is sourced from PubChem (CID 103028807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).