1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine

C11H15N3O3 — CID 70393933

IUPAC1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine
SMILESC1CCNCC1.O=c1[nH]c(=O)c2occc2[nH]1
InChIInChI=1S/C6H4N2O3.C5H11N/c9-5-4-3(1-2-11-4)7-6(10)8-5;1-2-4-6-5-3-1/h1-2H,(H2,7,8,9,10);6H,1-5H2
InChIKeyWGTDVIAUOLZCCP-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.57
Rot. Bonds

About 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine

1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine (PubChem CID 70393933) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine.

Molecular Properties

Compound Name1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine
PubChem CID70393933
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine
SMILESC1CCNCC1.O=c1[nH]c(=O)c2occc2[nH]1
InChIInChI=1S/C6H4N2O3.C5H11N/c9-5-4-3(1-2-11-4)7-6(10)8-5;1-2-4-6-5-3-1/h1-2H,(H2,7,8,9,10);6H,1-5H2
InChIKeyWGTDVIAUOLZCCP-UHFFFAOYSA-N
XLogP0.57
TPSA90.89 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine?
The IUPAC name of 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine (CID 70393933) is 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine.
What is the SMILES notation for 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine?
The canonical SMILES for 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine is C1CCNCC1.O=c1[nH]c(=O)c2occc2[nH]1.
What is the InChIKey of 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine?
The InChIKey is WGTDVIAUOLZCCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2O3.C5H11N/c9-5-4-3(1-2-11-4)7-6(10)8-5;1-2-4-6-5-3-1/h1-2H,(H2,7,8,9,10);6H,1-5H2.
What are the key properties of 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine?
1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine has a molecular weight of 237.26 g/mol, XLogP of 0.57, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-furo[3,2-d]pyrimidine-2,4-dione;piperidine is sourced from PubChem (CID 70393933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).