N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide

C11H19N3O2 — CID 116624420

IUPACN-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
SMILESCC(C)C(C)NC(=O)Cn1ccn(C)c1=O
InChIInChI=1S/C11H19N3O2/c1-8(2)9(3)12-10(15)7-14-6-5-13(4)11(14)16/h5-6,8-9H,7H2,1-4H3,(H,12,15)
InChIKeyHRBAFBMEWGNBOW-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.35
Rot. Bonds4

About N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide

N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide (PubChem CID 116624420) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
PubChem CID116624420
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
SMILESCC(C)C(C)NC(=O)Cn1ccn(C)c1=O
InChIInChI=1S/C11H19N3O2/c1-8(2)9(3)12-10(15)7-14-6-5-13(4)11(14)16/h5-6,8-9H,7H2,1-4H3,(H,12,15)
InChIKeyHRBAFBMEWGNBOW-UHFFFAOYSA-N
XLogP0.35
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylic acid
CID 61489099
N,N-dimethyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
CID 116624464
2-(3-ethyl-2-oxoimidazol-1-yl)-N-pentan-3-ylacetamide
CID 116624308
2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide
CID 79355641
(2S)-3-methyl-2-[[2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]butanoic acid
CID 61137273
2-[2-(ethylaminomethyl)pyrrol-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 66402539
2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 63801340
N-(3-methylbutan-2-yl)-2-[2-[(propan-2-ylamino)methyl]imidazol-1-yl]acetamide
CID 62222704
1-(5-aminohexyl)-3-methylimidazol-2-one
CID 80580709
2-(6-bromoindol-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 116621827
2-(6-aminoindol-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 61489016
2-[7-(hydroxymethyl)indol-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 102912115

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide (CID 116624420) is N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide is CC(C)C(C)NC(=O)Cn1ccn(C)c1=O.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
The InChIKey is HRBAFBMEWGNBOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-8(2)9(3)12-10(15)7-14-6-5-13(4)11(14)16/h5-6,8-9H,7H2,1-4H3,(H,12,15).
What are the key properties of N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide has a molecular weight of 225.29 g/mol, XLogP of 0.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide is sourced from PubChem (CID 116624420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).