2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol

C14H21NO2 — CID 2997936

IUPAC2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol
SMILESOC1CC(c2ccco2)NC2(CCCCC2)C1
InChIInChI=1S/C14H21NO2/c16-11-9-12(13-5-4-8-17-13)15-14(10-11)6-2-1-3-7-14/h4-5,8,11-12,15-16H,1-3,6-7,9-10H2
InChIKeyAIQYSLMWCIICFG-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.77
Rot. Bonds1

About 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol

2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol (PubChem CID 2997936) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol.

Molecular Properties

Compound Name2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol
PubChem CID2997936
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol
SMILESOC1CC(c2ccco2)NC2(CCCCC2)C1
InChIInChI=1S/C14H21NO2/c16-11-9-12(13-5-4-8-17-13)15-14(10-11)6-2-1-3-7-14/h4-5,8,11-12,15-16H,1-3,6-7,9-10H2
InChIKeyAIQYSLMWCIICFG-UHFFFAOYSA-N
XLogP2.77
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol?
The IUPAC name of 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol (CID 2997936) is 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol.
What is the SMILES notation for 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol?
The canonical SMILES for 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol is OC1CC(c2ccco2)NC2(CCCCC2)C1.
What is the InChIKey of 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol?
The InChIKey is AIQYSLMWCIICFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c16-11-9-12(13-5-4-8-17-13)15-14(10-11)6-2-1-3-7-14/h4-5,8,11-12,15-16H,1-3,6-7,9-10H2.
What are the key properties of 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol?
2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol has a molecular weight of 235.33 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-azaspiro[5.5]undecan-4-ol is sourced from PubChem (CID 2997936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).