3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione

C10H15N3O2 — CID 5310262

IUPAC3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione
SMILESCn1c(=O)cc(N2CCCCC2)[nH]c1=O
InChIInChI=1S/C10H15N3O2/c1-12-9(14)7-8(11-10(12)15)13-5-3-2-4-6-13/h7H,2-6H2,1H3,(H,11,15)
InChIKeyFPQAECSZKHNHNQ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.06
Rot. Bonds1

About 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione

3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione (PubChem CID 5310262) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione
PubChem CID5310262
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione
SMILESCn1c(=O)cc(N2CCCCC2)[nH]c1=O
InChIInChI=1S/C10H15N3O2/c1-12-9(14)7-8(11-10(12)15)13-5-3-2-4-6-13/h7H,2-6H2,1H3,(H,11,15)
InChIKeyFPQAECSZKHNHNQ-UHFFFAOYSA-N
XLogP0.06
TPSA58.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
The IUPAC name of 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione (CID 5310262) is 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione is Cn1c(=O)cc(N2CCCCC2)[nH]c1=O.
What is the InChIKey of 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
The InChIKey is FPQAECSZKHNHNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-12-9(14)7-8(11-10(12)15)13-5-3-2-4-6-13/h7H,2-6H2,1H3,(H,11,15).
What are the key properties of 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione has a molecular weight of 209.25 g/mol, XLogP of 0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 5310262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).