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

C10H15N3O — CID 13463840

IUPAC2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one
SMILESCc1ncc(N2CCCCC2)c(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-8-11-7-9(10(14)12-8)13-5-3-2-4-6-13/h7H,2-6H2,1H3,(H,11,12,14)
InChIKeyGBSHKZZYSWRRMS-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.07
Rot. Bonds1

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

2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one (PubChem CID 13463840) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one
PubChem CID13463840
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one
SMILESCc1ncc(N2CCCCC2)c(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-8-11-7-9(10(14)12-8)13-5-3-2-4-6-13/h7H,2-6H2,1H3,(H,11,12,14)
InChIKeyGBSHKZZYSWRRMS-UHFFFAOYSA-N
XLogP1.07
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-6-(piperidinomethyl)-4-pyrimidinol
CID 135472863
6-Amino-2-methyl-5-(1-piperazinyl)-4-pyrimidinol
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6-Amino-5-(4-cyano-1-piperazinyl)-2-methyl-4-pyrimidinol
CID 135444495
5,6-dimethyl-3-piperidin-1-yl-1H-pyrazin-2-one
CID 91052645
(5z)-2,3-Dimethyl-5-(piperidin-1-ylmethylidene)-3,5-dihydro-4h-imidazol-4-one
CID 154700618
5-amino-2-pentyl-1H-pyrimidin-6-one
CID 20276715
5-(dimethylamino)-2-methyl-1H-pyrimidin-6-one
CID 57597120
(6R)-6-methyl-3-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 58700505
5-[4-[[bis(3-aminopropyl)amino]methyl]piperidin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 66581314
2-[3-[[1-(2-methyl-6-oxo-1H-pyrimidin-5-yl)piperidin-4-yl]methylamino]propyl]guanidine
CID 66581807
2-methyl-5-(methylamino)-1H-pyrimidin-6-one
CID 83872302
2-[3-[3-(diaminomethylideneamino)propyl-[[1-(2-methyl-6-oxo-1H-pyrimidin-5-yl)piperidin-4-yl]methyl]amino]propyl]guanidine
CID 89495139

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one?
The IUPAC name of 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one (CID 13463840) is 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one?
The canonical SMILES for 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one is Cc1ncc(N2CCCCC2)c(=O)[nH]1.
What is the InChIKey of 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one?
The InChIKey is GBSHKZZYSWRRMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-11-7-9(10(14)12-8)13-5-3-2-4-6-13/h7H,2-6H2,1H3,(H,11,12,14).
What are the key properties of 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one?
2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 1.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-piperidin-1-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 13463840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).