4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one

C5H8N2O2 — CID 143209867

IUPAC4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one
SMILESCC1=CC(O)NC(=O)N1
InChIInChI=1S/C5H8N2O2/c1-3-2-4(8)7-5(9)6-3/h2,4,8H,1H3,(H2,6,7,9)
InChIKeyVWDHMRKEEPRZOW-UHFFFAOYSA-N
MW128.13 g/mol
LogP-0.48
Rot. Bonds

About 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one

4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one (PubChem CID 143209867) has the molecular formula C5H8N2O2 and a molecular weight of 128.13 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one
PubChem CID143209867
Molecular FormulaC5H8N2O2
Molecular Weight128.13 g/mol
Exact Mass128.06
IUPAC Name4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one
SMILESCC1=CC(O)NC(=O)N1
InChIInChI=1S/C5H8N2O2/c1-3-2-4(8)7-5(9)6-3/h2,4,8H,1H3,(H2,6,7,9)
InChIKeyVWDHMRKEEPRZOW-UHFFFAOYSA-N
XLogP-0.48
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 4-hydroxy-6-methyl-3,4-dihydro-1H-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 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one (CID 143209867) is 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one is CC1=CC(O)NC(=O)N1.
What is the InChIKey of 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one?
The InChIKey is VWDHMRKEEPRZOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O2/c1-3-2-4(8)7-5(9)6-3/h2,4,8H,1H3,(H2,6,7,9).
What are the key properties of 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one?
4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one has a molecular weight of 128.13 g/mol, XLogP of -0.48, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-3,4-dihydro-1H-pyrimidin-2-one is sourced from PubChem (CID 143209867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).