8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione

C12H17NO2 — CID 3498851

IUPAC8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione
SMILESO=C1CC2(CCCC2)CC(=O)N1C1CC1
InChIInChI=1S/C12H17NO2/c14-10-7-12(5-1-2-6-12)8-11(15)13(10)9-3-4-9/h9H,1-8H2
InChIKeyQKFYYPWHCAPUQM-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.86
Rot. Bonds1

About 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione

8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione (PubChem CID 3498851) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione.

Molecular Properties

Compound Name8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione
PubChem CID3498851
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione
SMILESO=C1CC2(CCCC2)CC(=O)N1C1CC1
InChIInChI=1S/C12H17NO2/c14-10-7-12(5-1-2-6-12)8-11(15)13(10)9-3-4-9/h9H,1-8H2
InChIKeyQKFYYPWHCAPUQM-UHFFFAOYSA-N
XLogP1.86
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione?
The IUPAC name of 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione (CID 3498851) is 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione.
What is the SMILES notation for 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione?
The canonical SMILES for 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione is O=C1CC2(CCCC2)CC(=O)N1C1CC1.
What is the InChIKey of 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione?
The InChIKey is QKFYYPWHCAPUQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c14-10-7-12(5-1-2-6-12)8-11(15)13(10)9-3-4-9/h9H,1-8H2.
What are the key properties of 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione?
8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione has a molecular weight of 207.27 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-8-azaspiro[4.5]decane-7,9-dione is sourced from PubChem (CID 3498851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).