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

C10H13N3O3 — CID 12848803

IUPAC5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
SMILESO=C(c1c[nH]c(=O)[nH]c1=O)N1CCCCC1
InChIInChI=1S/C10H13N3O3/c14-8-7(6-11-10(16)12-8)9(15)13-4-2-1-3-5-13/h6H,1-5H2,(H2,11,12,14,16)
InChIKeyWFISVDCXJUKGBU-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.31
Rot. Bonds1

About 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione

5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione (PubChem CID 12848803) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
PubChem CID12848803
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
SMILESO=C(c1c[nH]c(=O)[nH]c1=O)N1CCCCC1
InChIInChI=1S/C10H13N3O3/c14-8-7(6-11-10(16)12-8)9(15)13-4-2-1-3-5-13/h6H,1-5H2,(H2,11,12,14,16)
InChIKeyWFISVDCXJUKGBU-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

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Related Compounds

Chinoin 127
CID 155639
5-((Dimethylamino)methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
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N-butyl-1-methyl-2,4-dioxopyrimidine-5-carboxamide
CID 25185739
rel-(6R,9aS)-1,6,7,8,9,9a-Hexahydro-1,6-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
CID 12473939
1,3-Dimethyl-5-methylaminomethylene-6-aminouracil
CID 129789925
5-Fluoro-1-(piperidine-1-carbonyl)pyrimidine-2,4-dione
CID 70630603
5-(piperidin-1-ylmethyl)pyrimidine-2,4(1H,3H)-dione
CID 642681
5-(4-Methylpiperazinomethyl)uracil
CID 15031088
5-(Dihexylaminomethyl)uracil
CID 21625651
m-Piperidinyl thymine
CID 51050595
5-Fluoro-1-(piperidin-3-ylmethyl)pyrimidine-2,4-dione
CID 63557590
5-{[4-(2,2,2-trifluoroethyl)piperazin-1-yl]carbonyl}pyrimidine-2,4(1H,3H)-dione
CID 124215717

Frequently Asked Questions

What is the IUPAC name of 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione (CID 12848803) is 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione is O=C(c1c[nH]c(=O)[nH]c1=O)N1CCCCC1.
What is the InChIKey of 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
The InChIKey is WFISVDCXJUKGBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c14-8-7(6-11-10(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 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione?
5-(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 5-(piperidine-1-carbonyl)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 12848803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).