4,5-dihydro-1H-imidazole;ethene

C5H10N2 — CID 19755830

IUPAC4,5-dihydro-1H-imidazole;ethene
SMILESC1=NCCN1.C=C
InChIInChI=1S/C3H6N2.C2H4/c1-2-5-3-4-1;1-2/h3H,1-2H2,(H,4,5);1-2H2
InChIKeyMUFJRPBXRQDGCN-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.42
Rot. Bonds

About 4,5-dihydro-1H-imidazole;ethene

4,5-dihydro-1H-imidazole;ethene (PubChem CID 19755830) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 4,5-dihydro-1H-imidazole;ethene.

Molecular Properties

Compound Name4,5-dihydro-1H-imidazole;ethene
PubChem CID19755830
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name4,5-dihydro-1H-imidazole;ethene
SMILESC1=NCCN1.C=C
InChIInChI=1S/C3H6N2.C2H4/c1-2-5-3-4-1;1-2/h3H,1-2H2,(H,4,5);1-2H2
InChIKeyMUFJRPBXRQDGCN-UHFFFAOYSA-N
XLogP0.42
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1H-imidazole;ethene?
The IUPAC name of 4,5-dihydro-1H-imidazole;ethene (CID 19755830) is 4,5-dihydro-1H-imidazole;ethene.
What is the SMILES notation for 4,5-dihydro-1H-imidazole;ethene?
The canonical SMILES for 4,5-dihydro-1H-imidazole;ethene is C1=NCCN1.C=C.
What is the InChIKey of 4,5-dihydro-1H-imidazole;ethene?
The InChIKey is MUFJRPBXRQDGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2.C2H4/c1-2-5-3-4-1;1-2/h3H,1-2H2,(H,4,5);1-2H2.
What are the key properties of 4,5-dihydro-1H-imidazole;ethene?
4,5-dihydro-1H-imidazole;ethene has a molecular weight of 98.15 g/mol, XLogP of 0.42, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1H-imidazole;ethene is sourced from PubChem (CID 19755830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).