4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one

C9H13N3O2 — CID 63613107

IUPAC4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
SMILESCc1c(O)nc(N2CCCC2)[nH]c1=O
InChIInChI=1S/C9H13N3O2/c1-6-7(13)10-9(11-8(6)14)12-4-2-3-5-12/h2-5H2,1H3,(H2,10,11,13,14)
InChIKeyVGCBSNHWSLVSMA-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.38
Rot. Bonds1

About 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one

4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one (PubChem CID 63613107) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
PubChem CID63613107
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
SMILESCc1c(O)nc(N2CCCC2)[nH]c1=O
InChIInChI=1S/C9H13N3O2/c1-6-7(13)10-9(11-8(6)14)12-4-2-3-5-12/h2-5H2,1H3,(H2,10,11,13,14)
InChIKeyVGCBSNHWSLVSMA-UHFFFAOYSA-N
XLogP0.38
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-hydroxy-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
CID 30033457
5-Methyl-2-(methylamino)pyrimidine-4,6-diol
CID 63553729
4-hydroxy-5-methyl-2-piperidin-1-yl-1H-pyrimidin-6-one
CID 63613104
5,6-dimethyl-2-(pyrrolidin-1-yl)pyrimidin-4(3H)-one
CID 135631204
7-Hydroxy-2,2,6-trimethyl-1,3-dihydroimidazo[1,2-a]pyrimidin-5-one
CID 137152216
2-(Dimethylamino)-5-methylpyrimidine-4,6-diol
CID 4167791
4-hydroxy-5-propyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
CID 63611769
2-(diethylamino)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
CID 63612123
4-hydroxy-5-propan-2-yl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
CID 63612460
2-(diethylamino)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
CID 63612947
2-(azepan-1-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
CID 63613105
2-(diethylamino)-5-ethyl-4-hydroxy-1H-pyrimidin-6-one
CID 63613453

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one (CID 63613107) is 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one is Cc1c(O)nc(N2CCCC2)[nH]c1=O.
What is the InChIKey of 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one?
The InChIKey is VGCBSNHWSLVSMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-6-7(13)10-9(11-8(6)14)12-4-2-3-5-12/h2-5H2,1H3,(H2,10,11,13,14).
What are the key properties of 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one?
4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one has a molecular weight of 195.22 g/mol, XLogP of 0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-5-methyl-2-pyrrolidin-1-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 63613107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).