2-(3-ethenyl-2H-imidazol-1-yl)acetamide

C7H11N3O — CID 57094050

IUPAC2-(3-ethenyl-2H-imidazol-1-yl)acetamide
SMILESC=CN1C=CN(CC(N)=O)C1
InChIInChI=1S/C7H11N3O/c1-2-9-3-4-10(6-9)5-7(8)11/h2-4H,1,5-6H2,(H2,8,11)
InChIKeyIEJRMQNYWCJCDN-UHFFFAOYSA-N
MW153.18 g/mol
LogP-0.34
Rot. Bonds3

About 2-(3-ethenyl-2H-imidazol-1-yl)acetamide

2-(3-ethenyl-2H-imidazol-1-yl)acetamide (PubChem CID 57094050) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 2-(3-ethenyl-2H-imidazol-1-yl)acetamide.

Molecular Properties

Compound Name2-(3-ethenyl-2H-imidazol-1-yl)acetamide
PubChem CID57094050
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name2-(3-ethenyl-2H-imidazol-1-yl)acetamide
SMILESC=CN1C=CN(CC(N)=O)C1
InChIInChI=1S/C7H11N3O/c1-2-9-3-4-10(6-9)5-7(8)11/h2-4H,1,5-6H2,(H2,8,11)
InChIKeyIEJRMQNYWCJCDN-UHFFFAOYSA-N
XLogP-0.34
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethenyl-2H-imidazol-1-yl)acetamide?
The IUPAC name of 2-(3-ethenyl-2H-imidazol-1-yl)acetamide (CID 57094050) is 2-(3-ethenyl-2H-imidazol-1-yl)acetamide.
What is the SMILES notation for 2-(3-ethenyl-2H-imidazol-1-yl)acetamide?
The canonical SMILES for 2-(3-ethenyl-2H-imidazol-1-yl)acetamide is C=CN1C=CN(CC(N)=O)C1.
What is the InChIKey of 2-(3-ethenyl-2H-imidazol-1-yl)acetamide?
The InChIKey is IEJRMQNYWCJCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-2-9-3-4-10(6-9)5-7(8)11/h2-4H,1,5-6H2,(H2,8,11).
What are the key properties of 2-(3-ethenyl-2H-imidazol-1-yl)acetamide?
2-(3-ethenyl-2H-imidazol-1-yl)acetamide has a molecular weight of 153.18 g/mol, XLogP of -0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethenyl-2H-imidazol-1-yl)acetamide is sourced from PubChem (CID 57094050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).