5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione

C15H23NO3 — CID 112570665

IUPAC5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione
SMILESO=C1CC2(CCCOCC2)C(C2CCCC2)C(=O)N1
InChIInChI=1S/C15H23NO3/c17-12-10-15(6-3-8-19-9-7-15)13(14(18)16-12)11-4-1-2-5-11/h11,13H,1-10H2,(H,16,17,18)
InChIKeyXXNLNUMMENDCLD-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.03
Rot. Bonds1

About 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione

5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione (PubChem CID 112570665) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione.

Molecular Properties

Compound Name5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione
PubChem CID112570665
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione
SMILESO=C1CC2(CCCOCC2)C(C2CCCC2)C(=O)N1
InChIInChI=1S/C15H23NO3/c17-12-10-15(6-3-8-19-9-7-15)13(14(18)16-12)11-4-1-2-5-11/h11,13H,1-10H2,(H,16,17,18)
InChIKeyXXNLNUMMENDCLD-UHFFFAOYSA-N
XLogP2.03
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione?
The IUPAC name of 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione (CID 112570665) is 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione.
What is the SMILES notation for 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione?
The canonical SMILES for 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione is O=C1CC2(CCCOCC2)C(C2CCCC2)C(=O)N1.
What is the InChIKey of 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione?
The InChIKey is XXNLNUMMENDCLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c17-12-10-15(6-3-8-19-9-7-15)13(14(18)16-12)11-4-1-2-5-11/h11,13H,1-10H2,(H,16,17,18).
What are the key properties of 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione?
5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione has a molecular weight of 265.35 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-10-oxa-3-azaspiro[5.6]dodecane-2,4-dione is sourced from PubChem (CID 112570665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).