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

C7H11N3O2 — CID 11008331

IUPACN-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
SMILESCNC(=O)Cn1ccn(C)c1=O
InChIInChI=1S/C7H11N3O2/c1-8-6(11)5-10-4-3-9(2)7(10)12/h3-4H,5H2,1-2H3,(H,8,11)
InChIKeyVEWHQAVDZVOLDC-UHFFFAOYSA-N
MW169.18 g/mol
LogP-1.07
Rot. Bonds2

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

N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide (PubChem CID 11008331) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
PubChem CID11008331
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC NameN-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
SMILESCNC(=O)Cn1ccn(C)c1=O
InChIInChI=1S/C7H11N3O2/c1-8-6(11)5-10-4-3-9(2)7(10)12/h3-4H,5H2,1-2H3,(H,8,11)
InChIKeyVEWHQAVDZVOLDC-UHFFFAOYSA-N
XLogP-1.07
TPSA56.03 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 ≤ 5-1.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
The IUPAC name of N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide (CID 11008331) is N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide.
What is the SMILES notation for N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
The canonical SMILES for N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide is CNC(=O)Cn1ccn(C)c1=O.
What is the InChIKey of N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
The InChIKey is VEWHQAVDZVOLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-8-6(11)5-10-4-3-9(2)7(10)12/h3-4H,5H2,1-2H3,(H,8,11).
What are the key properties of N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide?
N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide has a molecular weight of 169.18 g/mol, XLogP of -1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methyl-2-oxoimidazol-1-yl)acetamide is sourced from PubChem (CID 11008331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).