N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide

C6H9N3O2 — CID 736895

IUPACN-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide
SMILESCC(=O)NC1=NC(=O)CN1C
InChIInChI=1S/C6H9N3O2/c1-4(10)7-6-8-5(11)3-9(6)2/h3H2,1-2H3,(H,7,8,10,11)
InChIKeyUGSZXEAELQBMMS-UHFFFAOYSA-N
MW155.16 g/mol
LogP-1.05
Rot. Bonds

About N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide

N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide (PubChem CID 736895) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide
PubChem CID736895
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC NameN-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide
SMILESCC(=O)NC1=NC(=O)CN1C
InChIInChI=1S/C6H9N3O2/c1-4(10)7-6-8-5(11)3-9(6)2/h3H2,1-2H3,(H,7,8,10,11)
InChIKeyUGSZXEAELQBMMS-UHFFFAOYSA-N
XLogP-1.05
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-1.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide?
The IUPAC name of N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide (CID 736895) is N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide.
What is the SMILES notation for N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide?
The canonical SMILES for N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide is CC(=O)NC1=NC(=O)CN1C.
What is the InChIKey of N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide?
The InChIKey is UGSZXEAELQBMMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-4(10)7-6-8-5(11)3-9(6)2/h3H2,1-2H3,(H,7,8,10,11).
What are the key properties of N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide?
N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide has a molecular weight of 155.16 g/mol, XLogP of -1.05, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-5-oxo-4H-imidazol-2-yl)acetamide is sourced from PubChem (CID 736895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).