6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione

C10H13N3O3 — CID 1241072

IUPAC6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
SMILESO=C(c1cc(=O)[nH]c(=O)[nH]1)N1CCCCC1
InChIInChI=1S/C10H13N3O3/c14-8-6-7(11-10(16)12-8)9(15)13-4-2-1-3-5-13/h6H,1-5H2,(H2,11,12,14,16)
InChIKeyZWXLVSZIZCAIHG-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.31
Rot. Bonds1

About 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione

6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione (PubChem CID 1241072) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
PubChem CID1241072
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
SMILESO=C(c1cc(=O)[nH]c(=O)[nH]1)N1CCCCC1
InChIInChI=1S/C10H13N3O3/c14-8-6-7(11-10(16)12-8)9(15)13-4-2-1-3-5-13/h6H,1-5H2,(H2,11,12,14,16)
InChIKeyZWXLVSZIZCAIHG-UHFFFAOYSA-N
XLogP-0.31
TPSA86.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione (CID 1241072) is 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione is O=C(c1cc(=O)[nH]c(=O)[nH]1)N1CCCCC1.
What is the InChIKey of 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
The InChIKey is ZWXLVSZIZCAIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c14-8-6-7(11-10(16)12-8)9(15)13-4-2-1-3-5-13/h6H,1-5H2,(H2,11,12,14,16).
What are the key properties of 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione has a molecular weight of 223.23 g/mol, XLogP of -0.31, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 1241072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).