N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide

C6H11N3O — CID 13492718

IUPACN-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide
SMILESCC(=O)NC1=NCCN1C
InChIInChI=1S/C6H11N3O/c1-5(10)8-6-7-3-4-9(6)2/h3-4H2,1-2H3,(H,7,8,10)
InChIKeyMGZXUROAKHDRAM-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.58
Rot. Bonds

About N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide

N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide (PubChem CID 13492718) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide
PubChem CID13492718
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC NameN-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide
SMILESCC(=O)NC1=NCCN1C
InChIInChI=1S/C6H11N3O/c1-5(10)8-6-7-3-4-9(6)2/h3-4H2,1-2H3,(H,7,8,10)
InChIKeyMGZXUROAKHDRAM-UHFFFAOYSA-N
XLogP-0.58
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide?
The IUPAC name of N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide (CID 13492718) is N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide.
What is the SMILES notation for N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide?
The canonical SMILES for N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide is CC(=O)NC1=NCCN1C.
What is the InChIKey of N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide?
The InChIKey is MGZXUROAKHDRAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-5(10)8-6-7-3-4-9(6)2/h3-4H2,1-2H3,(H,7,8,10).
What are the key properties of N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide?
N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide has a molecular weight of 141.17 g/mol, XLogP of -0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-4,5-dihydroimidazol-2-yl)acetamide is sourced from PubChem (CID 13492718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).