5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione

C10H15N3O2 — CID 51050595

IUPAC5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione
SMILESCc1cn(C2CCCNC2)c(=O)[nH]c1=O
InChIInChI=1S/C10H15N3O2/c1-7-6-13(10(15)12-9(7)14)8-3-2-4-11-5-8/h6,8,11H,2-5H2,1H3,(H,12,14,15)
InChIKeyBBLDMGQRHJEJKW-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.23
Rot. Bonds1

About 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione

5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione (PubChem CID 51050595) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione
PubChem CID51050595
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione
SMILESCc1cn(C2CCCNC2)c(=O)[nH]c1=O
InChIInChI=1S/C10H15N3O2/c1-7-6-13(10(15)12-9(7)14)8-3-2-4-11-5-8/h6,8,11H,2-5H2,1H3,(H,12,14,15)
InChIKeyBBLDMGQRHJEJKW-UHFFFAOYSA-N
XLogP-0.23
TPSA66.89 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 ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3S,5R)-5-hydroxypiperidin-3-yl]-5-methylpyrimidine-2,4-dione
CID 51050699
1-[(1S,3R)-3-hydroxycyclopentyl]-5-methylpyrimidine-2,4-dione
CID 10443092
1-[(4R)-4-hydroxypyrrolidin-3-yl]-5-methylpyrimidine-2,4-dione
CID 138975124
1-[(6S)-6-(hydroxymethyl)morpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 167109570
1-[(3S,4S)-1-cyclohexyl-4-hydroxypyrrolidin-3-yl]-5-methylpyrimidine-2,4-dione
CID 133065275
1-[(3S,4S)-3-hydroxy-3-methylpiperidin-4-yl]-5-methylpyrimidine-2,4-dione
CID 110144769
(2R,5S)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolane-2-carboxylic acid
CID 11356875
3-(2-methylimidazol-1-yl)piperidine;dihydrochloride
CID 54592668
1-[(5S)-5-methoxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
CID 71028658
3-cyclohexyl-5-methyl-1H-imidazol-2-one
CID 81446613
1-(7,7-dimethyl-6,8-dioxaspiro[3.5]nonan-2-yl)-5-methylpyrimidine-2,4-dione
CID 638926
1-[(2R,4S,5S)-4-hydroxy-5-methyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
CID 1277936

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione?
The IUPAC name of 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione (CID 51050595) is 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione.
What is the SMILES notation for 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione?
The canonical SMILES for 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione is Cc1cn(C2CCCNC2)c(=O)[nH]c1=O.
What is the InChIKey of 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione?
The InChIKey is BBLDMGQRHJEJKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7-6-13(10(15)12-9(7)14)8-3-2-4-11-5-8/h6,8,11H,2-5H2,1H3,(H,12,14,15).
What are the key properties of 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione?
5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione has a molecular weight of 209.25 g/mol, XLogP of -0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-piperidin-3-ylpyrimidine-2,4-dione is sourced from PubChem (CID 51050595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).