4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one

C11H17N3O2 — CID 105480524

IUPAC4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one
SMILESCOc1nc(C2CCCNC2)[nH]c(=O)c1C
InChIInChI=1S/C11H17N3O2/c1-7-10(15)13-9(14-11(7)16-2)8-4-3-5-12-6-8/h8,12H,3-6H2,1-2H3,(H,13,14,15)
InChIKeyUOCJBHKJLQPBKS-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.55
Rot. Bonds2

About 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one

4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one (PubChem CID 105480524) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one
PubChem CID105480524
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one
SMILESCOc1nc(C2CCCNC2)[nH]c(=O)c1C
InChIInChI=1S/C11H17N3O2/c1-7-10(15)13-9(14-11(7)16-2)8-4-3-5-12-6-8/h8,12H,3-6H2,1-2H3,(H,13,14,15)
InChIKeyUOCJBHKJLQPBKS-UHFFFAOYSA-N
XLogP0.55
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Launch Full Analysis

Related Compounds

5-fluoro-4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 80550884
5-ethyl-4-hydroxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 63554456
4-hydroxy-2-piperidin-3-yl-5-propyl-1H-pyrimidin-6-one
CID 63554457
4-hydroxy-2-piperidin-3-yl-5-propan-2-yl-1H-pyrimidin-6-one
CID 63554458
4-hydroxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 63554636
5-ethyl-4-hydroxy-2-piperidin-4-yl-1H-pyrimidin-6-one
CID 63554810
4-hydroxy-2-piperidin-4-yl-5-propan-2-yl-1H-pyrimidin-6-one
CID 63554995
4-hydroxy-5-methyl-2-piperidin-4-yl-1H-pyrimidin-6-one
CID 63555170
5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 84664921
4-methoxy-2-piperidin-4-yl-1H-pyrimidin-6-one
CID 105462846
4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
CID 105462847
4-methoxy-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 105462848

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one (CID 105480524) is 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one is COc1nc(C2CCCNC2)[nH]c(=O)c1C.
What is the InChIKey of 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one?
The InChIKey is UOCJBHKJLQPBKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-7-10(15)13-9(14-11(7)16-2)8-4-3-5-12-6-8/h8,12H,3-6H2,1-2H3,(H,13,14,15).
What are the key properties of 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one?
4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one has a molecular weight of 223.28 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-5-methyl-2-piperidin-3-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 105480524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).