2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one

C10H15N3O — CID 82401864

IUPAC2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one
SMILESCc1ncc(C2CCCCN2)c(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-7-12-6-8(10(14)13-7)9-4-2-3-5-11-9/h6,9,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyHVAGBELPQIBYNK-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.89
Rot. Bonds1

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

2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one (PubChem CID 82401864) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one
PubChem CID82401864
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one
SMILESCc1ncc(C2CCCCN2)c(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-7-12-6-8(10(14)13-7)9-4-2-3-5-11-9/h6,9,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyHVAGBELPQIBYNK-UHFFFAOYSA-N
XLogP0.89
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-(2-piperidin-4-ylethyl)-1H-pyrimidin-6-one
CID 153979522
5-butyl-2-methyl-1H-pyrimidin-6-one
CID 154318485
2-methyl-5-(2-methylidenepentyl)-1H-pyrimidin-6-one
CID 169977176
2,5-dipentyl-1H-pyrimidin-6-one
CID 174423087
4-hydroxy-2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one
CID 82395111
5-piperidin-2-yl-1H-pyrimidin-6-one
CID 82409514
5-ethyl-2-piperidin-2-yl-1H-pyrimidin-6-one
CID 84675418
5-methyl-2-(piperidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 84675424
5-ethyl-2-(piperidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 84686959
5-cyclopropyl-2-(piperidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 84696947
5-(2-methylpropyl)-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 84698894
5-(2-methylpropyl)-2-piperidin-2-yl-1H-pyrimidin-6-one
CID 84698896

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one?
The IUPAC name of 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one (CID 82401864) is 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one?
The canonical SMILES for 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one is Cc1ncc(C2CCCCN2)c(=O)[nH]1.
What is the InChIKey of 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one?
The InChIKey is HVAGBELPQIBYNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-7-12-6-8(10(14)13-7)9-4-2-3-5-11-9/h6,9,11H,2-5H2,1H3,(H,12,13,14).
What are the key properties of 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one?
2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-piperidin-2-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 82401864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).