1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one

C8H10N2O2 — CID 71468616

IUPAC1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one
SMILESCc1nc(=O)n(O)c2c1CCC2
InChIInChI=1S/C8H10N2O2/c1-5-6-3-2-4-7(6)10(12)8(11)9-5/h12H,2-4H2,1H3
InChIKeyCNKXEAUJGFAEIT-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.28
Rot. Bonds

About 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one

1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one (PubChem CID 71468616) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one.

Molecular Properties

Compound Name1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one
PubChem CID71468616
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one
SMILESCc1nc(=O)n(O)c2c1CCC2
InChIInChI=1S/C8H10N2O2/c1-5-6-3-2-4-7(6)10(12)8(11)9-5/h12H,2-4H2,1H3
InChIKeyCNKXEAUJGFAEIT-UHFFFAOYSA-N
XLogP0.28
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

Analyze 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one 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 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one?
The IUPAC name of 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one (CID 71468616) is 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one.
What is the SMILES notation for 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one?
The canonical SMILES for 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one is Cc1nc(=O)n(O)c2c1CCC2.
What is the InChIKey of 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one?
The InChIKey is CNKXEAUJGFAEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-5-6-3-2-4-7(6)10(12)8(11)9-5/h12H,2-4H2,1H3.
What are the key properties of 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one?
1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one has a molecular weight of 166.18 g/mol, XLogP of 0.28, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one is sourced from PubChem (CID 71468616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).