4-ethyl-1,3-dihydroimidazol-2-one

C5H8N2O — CID 15567528

IUPAC4-ethyl-1,3-dihydroimidazol-2-one
SMILESCCc1c[nH]c(=O)[nH]1
InChIInChI=1S/C5H8N2O/c1-2-4-3-6-5(8)7-4/h3H,2H2,1H3,(H2,6,7,8)
InChIKeyYNKXUNTWNWDIED-UHFFFAOYSA-N
MW112.13 g/mol
LogP0.27
Rot. Bonds1

About 4-ethyl-1,3-dihydroimidazol-2-one

4-ethyl-1,3-dihydroimidazol-2-one (PubChem CID 15567528) has the molecular formula C5H8N2O and a molecular weight of 112.13 g/mol. Its IUPAC name is 4-ethyl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-ethyl-1,3-dihydroimidazol-2-one
PubChem CID15567528
Molecular FormulaC5H8N2O
Molecular Weight112.13 g/mol
Exact Mass112.06
IUPAC Name4-ethyl-1,3-dihydroimidazol-2-one
SMILESCCc1c[nH]c(=O)[nH]1
InChIInChI=1S/C5H8N2O/c1-2-4-3-6-5(8)7-4/h3H,2H2,1H3,(H2,6,7,8)
InChIKeyYNKXUNTWNWDIED-UHFFFAOYSA-N
XLogP0.27
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-ethyl-1,3-dihydroimidazol-2-one (CID 15567528) is 4-ethyl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-ethyl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-ethyl-1,3-dihydroimidazol-2-one is CCc1c[nH]c(=O)[nH]1.
What is the InChIKey of 4-ethyl-1,3-dihydroimidazol-2-one?
The InChIKey is YNKXUNTWNWDIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O/c1-2-4-3-6-5(8)7-4/h3H,2H2,1H3,(H2,6,7,8).
What are the key properties of 4-ethyl-1,3-dihydroimidazol-2-one?
4-ethyl-1,3-dihydroimidazol-2-one has a molecular weight of 112.13 g/mol, XLogP of 0.27, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 15567528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).