3-ethenyl-2,4-dihydroimidazole

C5H8N2 — CID 54420870

IUPAC3-ethenyl-2,4-dihydroimidazole
SMILESC=CN1CC=NC1
InChIInChI=1S/C5H8N2/c1-2-7-4-3-6-5-7/h2-3H,1,4-5H2
InChIKeyWARZDSSJZMESMF-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.47
Rot. Bonds1

About 3-ethenyl-2,4-dihydroimidazole

3-ethenyl-2,4-dihydroimidazole (PubChem CID 54420870) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is 3-ethenyl-2,4-dihydroimidazole.

Molecular Properties

Compound Name3-ethenyl-2,4-dihydroimidazole
PubChem CID54420870
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name3-ethenyl-2,4-dihydroimidazole
SMILESC=CN1CC=NC1
InChIInChI=1S/C5H8N2/c1-2-7-4-3-6-5-7/h2-3H,1,4-5H2
InChIKeyWARZDSSJZMESMF-UHFFFAOYSA-N
XLogP0.47
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2,4-dihydroimidazole?
The IUPAC name of 3-ethenyl-2,4-dihydroimidazole (CID 54420870) is 3-ethenyl-2,4-dihydroimidazole.
What is the SMILES notation for 3-ethenyl-2,4-dihydroimidazole?
The canonical SMILES for 3-ethenyl-2,4-dihydroimidazole is C=CN1CC=NC1.
What is the InChIKey of 3-ethenyl-2,4-dihydroimidazole?
The InChIKey is WARZDSSJZMESMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-2-7-4-3-6-5-7/h2-3H,1,4-5H2.
What are the key properties of 3-ethenyl-2,4-dihydroimidazole?
3-ethenyl-2,4-dihydroimidazole has a molecular weight of 96.13 g/mol, XLogP of 0.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2,4-dihydroimidazole is sourced from PubChem (CID 54420870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).