1,2-bis[(Z)-but-1-enyl]imidazole

C11H16N2 — CID 178159096

IUPAC1,2-bis[(Z)-but-1-enyl]imidazole
SMILESCC/C=C\c1nccn1/C=C\CC
InChIInChI=1S/C11H16N2/c1-3-5-7-11-12-8-10-13(11)9-6-4-2/h5-10H,3-4H2,1-2H3/b7-5-,9-6-
InChIKeyZTVRDQOVYBDKIM-BSIYMUDXSA-N
MW176.26 g/mol
LogP3.19
Rot. Bonds4

About 1,2-bis[(Z)-but-1-enyl]imidazole

1,2-bis[(Z)-but-1-enyl]imidazole (PubChem CID 178159096) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 1,2-bis[(Z)-but-1-enyl]imidazole.

Molecular Properties

Compound Name1,2-bis[(Z)-but-1-enyl]imidazole
PubChem CID178159096
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name1,2-bis[(Z)-but-1-enyl]imidazole
SMILESCC/C=C\c1nccn1/C=C\CC
InChIInChI=1S/C11H16N2/c1-3-5-7-11-12-8-10-13(11)9-6-4-2/h5-10H,3-4H2,1-2H3/b7-5-,9-6-
InChIKeyZTVRDQOVYBDKIM-BSIYMUDXSA-N
XLogP3.19
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-bis[(Z)-but-1-enyl]imidazole?
The IUPAC name of 1,2-bis[(Z)-but-1-enyl]imidazole (CID 178159096) is 1,2-bis[(Z)-but-1-enyl]imidazole.
What is the SMILES notation for 1,2-bis[(Z)-but-1-enyl]imidazole?
The canonical SMILES for 1,2-bis[(Z)-but-1-enyl]imidazole is CC/C=C\c1nccn1/C=C\CC.
What is the InChIKey of 1,2-bis[(Z)-but-1-enyl]imidazole?
The InChIKey is ZTVRDQOVYBDKIM-BSIYMUDXSA-N. The full InChI is InChI=1S/C11H16N2/c1-3-5-7-11-12-8-10-13(11)9-6-4-2/h5-10H,3-4H2,1-2H3/b7-5-,9-6-.
What are the key properties of 1,2-bis[(Z)-but-1-enyl]imidazole?
1,2-bis[(Z)-but-1-enyl]imidazole has a molecular weight of 176.26 g/mol, XLogP of 3.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis[(Z)-but-1-enyl]imidazole is sourced from PubChem (CID 178159096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).