1-ethenyl-3-(1-methoxyethyl)-2H-imidazole

C8H14N2O — CID 175359883

IUPAC1-ethenyl-3-(1-methoxyethyl)-2H-imidazole
SMILESC=CN1C=CN(C(C)OC)C1
InChIInChI=1S/C8H14N2O/c1-4-9-5-6-10(7-9)8(2)11-3/h4-6,8H,1,7H2,2-3H3
InChIKeyYRRCPWSKPVNICD-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.17
Rot. Bonds3

About 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole

1-ethenyl-3-(1-methoxyethyl)-2H-imidazole (PubChem CID 175359883) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole.

Molecular Properties

Compound Name1-ethenyl-3-(1-methoxyethyl)-2H-imidazole
PubChem CID175359883
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name1-ethenyl-3-(1-methoxyethyl)-2H-imidazole
SMILESC=CN1C=CN(C(C)OC)C1
InChIInChI=1S/C8H14N2O/c1-4-9-5-6-10(7-9)8(2)11-3/h4-6,8H,1,7H2,2-3H3
InChIKeyYRRCPWSKPVNICD-UHFFFAOYSA-N
XLogP1.17
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole?
The IUPAC name of 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole (CID 175359883) is 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole.
What is the SMILES notation for 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole?
The canonical SMILES for 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole is C=CN1C=CN(C(C)OC)C1.
What is the InChIKey of 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole?
The InChIKey is YRRCPWSKPVNICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-4-9-5-6-10(7-9)8(2)11-3/h4-6,8H,1,7H2,2-3H3.
What are the key properties of 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole?
1-ethenyl-3-(1-methoxyethyl)-2H-imidazole has a molecular weight of 154.21 g/mol, XLogP of 1.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3-(1-methoxyethyl)-2H-imidazole is sourced from PubChem (CID 175359883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).