5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol

C13H25NO — CID 106131344

IUPAC5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol
SMILESCC(O)CCCN1CC2(CCCCC2)C1
InChIInChI=1S/C13H25NO/c1-12(15)6-5-9-14-10-13(11-14)7-3-2-4-8-13/h12,15H,2-11H2,1H3
InChIKeyWBFBYZRSPCAZEV-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.41
Rot. Bonds4

About 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol

5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol (PubChem CID 106131344) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol.

Molecular Properties

Compound Name5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol
PubChem CID106131344
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol
SMILESCC(O)CCCN1CC2(CCCCC2)C1
InChIInChI=1S/C13H25NO/c1-12(15)6-5-9-14-10-13(11-14)7-3-2-4-8-13/h12,15H,2-11H2,1H3
InChIKeyWBFBYZRSPCAZEV-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol?
The IUPAC name of 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol (CID 106131344) is 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol.
What is the SMILES notation for 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol?
The canonical SMILES for 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol is CC(O)CCCN1CC2(CCCCC2)C1.
What is the InChIKey of 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol?
The InChIKey is WBFBYZRSPCAZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-12(15)6-5-9-14-10-13(11-14)7-3-2-4-8-13/h12,15H,2-11H2,1H3.
What are the key properties of 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol?
5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol has a molecular weight of 211.35 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol is sourced from PubChem (CID 106131344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).