2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole

C13H19FN2 — CID 142019886

IUPAC2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole
SMILESC=C(F)c1nc(CC)n(CCC)c1/C=C\C
InChIInChI=1S/C13H19FN2/c1-5-8-11-13(10(4)14)15-12(7-3)16(11)9-6-2/h5,8H,4,6-7,9H2,1-3H3/b8-5-
InChIKeyOQJSTRHJQZHRDV-YVMONPNESA-N
MW222.31 g/mol
LogP3.83
Rot. Bonds5

About 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole

2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole (PubChem CID 142019886) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole.

Molecular Properties

Compound Name2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole
PubChem CID142019886
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole
SMILESC=C(F)c1nc(CC)n(CCC)c1/C=C\C
InChIInChI=1S/C13H19FN2/c1-5-8-11-13(10(4)14)15-12(7-3)16(11)9-6-2/h5,8H,4,6-7,9H2,1-3H3/b8-5-
InChIKeyOQJSTRHJQZHRDV-YVMONPNESA-N
XLogP3.83
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole?
The IUPAC name of 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole (CID 142019886) is 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole.
What is the SMILES notation for 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole?
The canonical SMILES for 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole is C=C(F)c1nc(CC)n(CCC)c1/C=C\C.
What is the InChIKey of 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole?
The InChIKey is OQJSTRHJQZHRDV-YVMONPNESA-N. The full InChI is InChI=1S/C13H19FN2/c1-5-8-11-13(10(4)14)15-12(7-3)16(11)9-6-2/h5,8H,4,6-7,9H2,1-3H3/b8-5-.
What are the key properties of 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole?
2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole has a molecular weight of 222.31 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(1-fluoroethenyl)-5-[(Z)-prop-1-enyl]-1-propylimidazole is sourced from PubChem (CID 142019886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).