4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one

C10H15N3O2 — CID 136957340

IUPAC4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one
SMILESCc1nc(N2CCC(O)CC2)cc(=O)[nH]1
InChIInChI=1S/C10H15N3O2/c1-7-11-9(6-10(15)12-7)13-4-2-8(14)3-5-13/h6,8,14H,2-5H2,1H3,(H,11,12,15)
InChIKeySWTWDFAOSBVVPJ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.04
Rot. Bonds1

About 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one

4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one (PubChem CID 136957340) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one
PubChem CID136957340
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one
SMILESCc1nc(N2CCC(O)CC2)cc(=O)[nH]1
InChIInChI=1S/C10H15N3O2/c1-7-11-9(6-10(15)12-7)13-4-2-8(14)3-5-13/h6,8,14H,2-5H2,1H3,(H,11,12,15)
InChIKeySWTWDFAOSBVVPJ-UHFFFAOYSA-N
XLogP0.04
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-Hydroxypiperidin-1-yl)-3,4-dihydropyrimidin-4-one
CID 136957342
4-Hydroxy-2-methyl-6-(piperidin-1-yl)pyrimidine
CID 137000217
2-methyl-4-(1-methylpiperidin-4-yl)oxy-1H-pyrimidin-6-one
CID 103241483
4-(3-hydroxy-4-methylpiperidin-1-yl)-2-propan-2-yl-1H-pyrimidin-6-one
CID 136749163
2-ethyl-4-(3-hydroxy-4-methylpiperidin-1-yl)-1H-pyrimidin-6-one
CID 136749164
4-(3-hydroxy-4-methylpiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one
CID 136749165
4-[5-hydroxypentyl(methyl)amino]-2-methyl-1H-pyrimidin-6-one
CID 136766327
2-ethyl-4-[4-(1-hydroxyethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136772448
4-[4-(1-hydroxyethyl)piperidin-1-yl]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136772449
2-cyclopropyl-4-[4-(1-hydroxyethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136772453
4-[4-(1-hydroxyethyl)piperidin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 136772454
2-amino-6-(4-hydroxypiperidin-1-yl)pyrimidin-4(3H)-one
CID 136776209

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one?
The IUPAC name of 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one (CID 136957340) is 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one is Cc1nc(N2CCC(O)CC2)cc(=O)[nH]1.
What is the InChIKey of 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one?
The InChIKey is SWTWDFAOSBVVPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7-11-9(6-10(15)12-7)13-4-2-8(14)3-5-13/h6,8,14H,2-5H2,1H3,(H,11,12,15).
What are the key properties of 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one?
4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one has a molecular weight of 209.25 g/mol, XLogP of 0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxypiperidin-1-yl)-2-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 136957340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).