4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one

C10H15N3O2 — CID 105462848

IUPAC4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one
SMILESCOc1cc(=O)[nH]c(C2CCCNC2)n1
InChIInChI=1S/C10H15N3O2/c1-15-9-5-8(14)12-10(13-9)7-3-2-4-11-6-7/h5,7,11H,2-4,6H2,1H3,(H,12,13,14)
InChIKeyQXGJMXKKWWNDLP-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.25
Rot. Bonds2

About 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one

4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one (PubChem CID 105462848) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one
PubChem CID105462848
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one
SMILESCOc1cc(=O)[nH]c(C2CCCNC2)n1
InChIInChI=1S/C10H15N3O2/c1-15-9-5-8(14)12-10(13-9)7-3-2-4-11-6-7/h5,7,11H,2-4,6H2,1H3,(H,12,13,14)
InChIKeyQXGJMXKKWWNDLP-UHFFFAOYSA-N
XLogP0.25
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 136103141
5-fluoro-4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 80550884
2-(1-ethylpiperidin-4-yl)-4-hydroxy-1H-pyrimidin-6-one
CID 22618160
4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 63554635
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-methylpiperidin-3-yl)-1H-pyrimidin-6-one;propanal
CID 153615477
4-hydroxy-2-(6-methylpiperidin-1-id-3-yl)-1H-pyrimidin-6-one;methanol;yttrium
CID 153615514
methyl 3-(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)piperidine-1-carboxylate
CID 153615730
4-hydroxy-2-(1-propanoylpiperidin-3-yl)-1H-pyrimidin-6-one
CID 154942917
2-(1-acetylpiperidin-3-yl)-4-hydroxy-1H-pyrimidin-6-one
CID 154942949
2-(1-ethyl-6-methylpiperidin-3-yl)-4-hydroxy-1H-pyrimidin-6-one
CID 170102342

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one (CID 105462848) is 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one is COc1cc(=O)[nH]c(C2CCCNC2)n1.
What is the InChIKey of 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one?
The InChIKey is QXGJMXKKWWNDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-15-9-5-8(14)12-10(13-9)7-3-2-4-11-6-7/h5,7,11H,2-4,6H2,1H3,(H,12,13,14).
What are the key properties of 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one?
4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one has a molecular weight of 209.25 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 105462848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).