2,5-bis(ethenyl)-1H-imidazole

C7H8N2 — CID 54257741

IUPAC2,5-bis(ethenyl)-1H-imidazole
SMILESC=Cc1cnc(C=C)[nH]1
InChIInChI=1S/C7H8N2/c1-3-6-5-8-7(4-2)9-6/h3-5H,1-2H2,(H,8,9)
InChIKeyRBGVQZVVRBSPBX-UHFFFAOYSA-N
MW120.15 g/mol
LogP1.70
Rot. Bonds2

About 2,5-bis(ethenyl)-1H-imidazole

2,5-bis(ethenyl)-1H-imidazole (PubChem CID 54257741) has the molecular formula C7H8N2 and a molecular weight of 120.15 g/mol. Its IUPAC name is 2,5-bis(ethenyl)-1H-imidazole.

Molecular Properties

Compound Name2,5-bis(ethenyl)-1H-imidazole
PubChem CID54257741
Molecular FormulaC7H8N2
Molecular Weight120.15 g/mol
Exact Mass120.07
IUPAC Name2,5-bis(ethenyl)-1H-imidazole
SMILESC=Cc1cnc(C=C)[nH]1
InChIInChI=1S/C7H8N2/c1-3-6-5-8-7(4-2)9-6/h3-5H,1-2H2,(H,8,9)
InChIKeyRBGVQZVVRBSPBX-UHFFFAOYSA-N
XLogP1.70
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(ethenyl)-1H-imidazole?
The IUPAC name of 2,5-bis(ethenyl)-1H-imidazole (CID 54257741) is 2,5-bis(ethenyl)-1H-imidazole.
What is the SMILES notation for 2,5-bis(ethenyl)-1H-imidazole?
The canonical SMILES for 2,5-bis(ethenyl)-1H-imidazole is C=Cc1cnc(C=C)[nH]1.
What is the InChIKey of 2,5-bis(ethenyl)-1H-imidazole?
The InChIKey is RBGVQZVVRBSPBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2/c1-3-6-5-8-7(4-2)9-6/h3-5H,1-2H2,(H,8,9).
What are the key properties of 2,5-bis(ethenyl)-1H-imidazole?
2,5-bis(ethenyl)-1H-imidazole has a molecular weight of 120.15 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(ethenyl)-1H-imidazole is sourced from PubChem (CID 54257741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).