2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one

C8H10N2O2 — CID 135855074

IUPAC2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one
SMILESO=C1CCC(O)=C1C1=NCCN1
InChIInChI=1S/C8H10N2O2/c11-5-1-2-6(12)7(5)8-9-3-4-10-8/h11H,1-4H2,(H,9,10)
InChIKeyHLXQZDQAMOHUFN-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.16
Rot. Bonds1

About 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one

2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one (PubChem CID 135855074) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one.

Molecular Properties

Compound Name2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one
PubChem CID135855074
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one
SMILESO=C1CCC(O)=C1C1=NCCN1
InChIInChI=1S/C8H10N2O2/c11-5-1-2-6(12)7(5)8-9-3-4-10-8/h11H,1-4H2,(H,9,10)
InChIKeyHLXQZDQAMOHUFN-UHFFFAOYSA-N
XLogP0.16
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one?
The IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one (CID 135855074) is 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one.
What is the SMILES notation for 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one?
The canonical SMILES for 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one is O=C1CCC(O)=C1C1=NCCN1.
What is the InChIKey of 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one?
The InChIKey is HLXQZDQAMOHUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c11-5-1-2-6(12)7(5)8-9-3-4-10-8/h11H,1-4H2,(H,9,10).
What are the key properties of 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one?
2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one has a molecular weight of 166.18 g/mol, XLogP of 0.16, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1H-imidazol-2-yl)-3-hydroxycyclopent-2-en-1-one is sourced from PubChem (CID 135855074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).