N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide

C11H12Br2N2O2 — CID 103908225

IUPACN-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide
SMILESCC(C)(NC(=O)c1cc(Br)cc(Br)c1)C(N)=O
InChIInChI=1S/C11H12Br2N2O2/c1-11(2,10(14)17)15-9(16)6-3-7(12)5-8(13)4-6/h3-5H,1-2H3,(H2,14,17)(H,15,16)
InChIKeyHRDVJVMCZIKURJ-UHFFFAOYSA-N
MW364.04 g/mol
LogP2.21
Rot. Bonds3

About N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide

N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide (PubChem CID 103908225) has the molecular formula C11H12Br2N2O2 and a molecular weight of 364.04 g/mol. Its IUPAC name is N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide.

Molecular Properties

Compound NameN-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide
PubChem CID103908225
Molecular FormulaC11H12Br2N2O2
Molecular Weight364.04 g/mol
Exact Mass361.93
IUPAC NameN-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide
SMILESCC(C)(NC(=O)c1cc(Br)cc(Br)c1)C(N)=O
InChIInChI=1S/C11H12Br2N2O2/c1-11(2,10(14)17)15-9(16)6-3-7(12)5-8(13)4-6/h3-5H,1-2H3,(H2,14,17)(H,15,16)
InChIKeyHRDVJVMCZIKURJ-UHFFFAOYSA-N
XLogP2.21
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.04
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-bromobenzamide
CID 55137937
N-(1-amino-2-methyl-1-oxopropan-2-yl)-5-bromothiophene-3-carboxamide
CID 61219456
2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide
CID 122583234
3,5-dibromo-N-(2-methylbut-3-yn-2-yl)benzamide
CID 103908693
methyl 2-[(3-bromo-5-methylbenzoyl)amino]-2-methylpropanoate
CID 104852229
3,5-dibromo-N-(1-hydroxy-3-methylpentan-3-yl)benzamide
CID 103946097
N-(1-amino-2-methyl-1-oxopropan-2-yl)-5-bromo-2-chloropyridine-3-carboxamide
CID 62000658
2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)pyridine-4-carboxamide
CID 62184832
methyl 2-[(3,5-dibromobenzoyl)amino]-2-methylpentanoate
CID 107973836
N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-fluoro-3-sulfanylbenzamide
CID 107027425
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2-chloropyridine-4-carboxamide
CID 61217075
3,5-dibromo-N-[2-(tert-butylamino)-2-oxoethyl]benzamide
CID 103907463

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide?
The IUPAC name of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide (CID 103908225) is N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide.
What is the SMILES notation for N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide?
The canonical SMILES for N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide is CC(C)(NC(=O)c1cc(Br)cc(Br)c1)C(N)=O.
What is the InChIKey of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide?
The InChIKey is HRDVJVMCZIKURJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Br2N2O2/c1-11(2,10(14)17)15-9(16)6-3-7(12)5-8(13)4-6/h3-5H,1-2H3,(H2,14,17)(H,15,16).
What are the key properties of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide?
N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide has a molecular weight of 364.04 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methyl-1-oxopropan-2-yl)-3,5-dibromobenzamide is sourced from PubChem (CID 103908225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).