2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide

C7H11N3O2 — CID 19350750

IUPAC2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide
SMILESCc1cn(CC(N)=O)c(=O)n1C
InChIInChI=1S/C7H11N3O2/c1-5-3-10(4-6(8)11)7(12)9(5)2/h3H,4H2,1-2H3,(H2,8,11)
InChIKeyQLRAVRORIRYEJY-UHFFFAOYSA-N
MW169.18 g/mol
LogP-1.02
Rot. Bonds2

About 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide

2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide (PubChem CID 19350750) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide
PubChem CID19350750
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide
SMILESCc1cn(CC(N)=O)c(=O)n1C
InChIInChI=1S/C7H11N3O2/c1-5-3-10(4-6(8)11)7(12)9(5)2/h3H,4H2,1-2H3,(H2,8,11)
InChIKeyQLRAVRORIRYEJY-UHFFFAOYSA-N
XLogP-1.02
TPSA70.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-1.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide?
The IUPAC name of 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide (CID 19350750) is 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide.
What is the SMILES notation for 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide?
The canonical SMILES for 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide is Cc1cn(CC(N)=O)c(=O)n1C.
What is the InChIKey of 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide?
The InChIKey is QLRAVRORIRYEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-5-3-10(4-6(8)11)7(12)9(5)2/h3H,4H2,1-2H3,(H2,8,11).
What are the key properties of 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide?
2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide has a molecular weight of 169.18 g/mol, XLogP of -1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethyl-2-oxoimidazol-1-yl)acetamide is sourced from PubChem (CID 19350750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).