4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one

C12H19N3O2 — CID 63554458

IUPAC4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one
SMILESCC(C)c1c(O)nc(C2CCCNC2)[nH]c1=O
InChIInChI=1S/C12H19N3O2/c1-7(2)9-11(16)14-10(15-12(9)17)8-4-3-5-13-6-8/h7-8,13H,3-6H2,1-2H3,(H2,14,15,16,17)
InChIKeyUEWAQANCTBAKHC-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.07
Rot. Bonds2

About 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one

4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one (PubChem CID 63554458) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one
PubChem CID63554458
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one
SMILESCC(C)c1c(O)nc(C2CCCNC2)[nH]c1=O
InChIInChI=1S/C12H19N3O2/c1-7(2)9-11(16)14-10(15-12(9)17)8-4-3-5-13-6-8/h7-8,13H,3-6H2,1-2H3,(H2,14,15,16,17)
InChIKeyUEWAQANCTBAKHC-UHFFFAOYSA-N
XLogP1.07
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-2-piperidin-3-yl-5-propan-2-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

5-fluoro-4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 80550884
2-cyclopropyl-4-hydroxy-5-[3-(methylamino)propyl]-1H-pyrimidin-6-one
CID 57713872
4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 63554635
4-hydroxy-2-methyl-5-piperidin-4-yl-1H-pyrimidin-6-one
CID 90956795
4-hydroxy-2-(1-methylpiperidin-3-yl)-1H-pyrimidin-6-one
CID 117708726
4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one;hydrochloride
CID 153615359
4-hydroxy-2-(1-propanoylpiperidin-3-yl)-1H-pyrimidin-6-one
CID 154942917
2-Hydroxy-3-propan-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 156101952
2-Methyl-5-(piperidylmethyl)pyrimidine-4,6-diol
CID 3489834
5-ethyl-4-hydroxy-2-(piperazin-1-ylmethyl)-1H-pyrimidin-6-one
CID 55221351
4-hydroxy-2-(1-piperazin-1-ylethyl)-5-propyl-1H-pyrimidin-6-one
CID 55221461
4-hydroxy-2-(1-piperazin-1-ylethyl)-5-propan-2-yl-1H-pyrimidin-6-one
CID 63553746

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one (CID 63554458) is 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one is CC(C)c1c(O)nc(C2CCCNC2)[nH]c1=O.
What is the InChIKey of 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one?
The InChIKey is UEWAQANCTBAKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-7(2)9-11(16)14-10(15-12(9)17)8-4-3-5-13-6-8/h7-8,13H,3-6H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one?
4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one has a molecular weight of 237.30 g/mol, XLogP of 1.07, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 63554458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).