1-(2-methoxyethyl)-4,5-dihydroimidazole

C6H12N2O — CID 11629606

IUPAC1-(2-methoxyethyl)-4,5-dihydroimidazole
SMILESCOCCN1C=NCC1
InChIInChI=1S/C6H12N2O/c1-9-5-4-8-3-2-7-6-8/h6H,2-5H2,1H3
InChIKeyJLLLHOYWOTZJFH-UHFFFAOYSA-N
MW128.17 g/mol
LogP-0.02
Rot. Bonds3

About 1-(2-methoxyethyl)-4,5-dihydroimidazole

1-(2-methoxyethyl)-4,5-dihydroimidazole (PubChem CID 11629606) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4,5-dihydroimidazole
PubChem CID11629606
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Name1-(2-methoxyethyl)-4,5-dihydroimidazole
SMILESCOCCN1C=NCC1
InChIInChI=1S/C6H12N2O/c1-9-5-4-8-3-2-7-6-8/h6H,2-5H2,1H3
InChIKeyJLLLHOYWOTZJFH-UHFFFAOYSA-N
XLogP-0.02
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4,5-dihydroimidazole?
The IUPAC name of 1-(2-methoxyethyl)-4,5-dihydroimidazole (CID 11629606) is 1-(2-methoxyethyl)-4,5-dihydroimidazole.
What is the SMILES notation for 1-(2-methoxyethyl)-4,5-dihydroimidazole?
The canonical SMILES for 1-(2-methoxyethyl)-4,5-dihydroimidazole is COCCN1C=NCC1.
What is the InChIKey of 1-(2-methoxyethyl)-4,5-dihydroimidazole?
The InChIKey is JLLLHOYWOTZJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-9-5-4-8-3-2-7-6-8/h6H,2-5H2,1H3.
What are the key properties of 1-(2-methoxyethyl)-4,5-dihydroimidazole?
1-(2-methoxyethyl)-4,5-dihydroimidazole has a molecular weight of 128.17 g/mol, XLogP of -0.02, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4,5-dihydroimidazole is sourced from PubChem (CID 11629606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).