[4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol

C11H19NO2 — CID 106299445

IUPAC[4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol
SMILESOCC1(N2CC3(CC3)C2)CCOCC1
InChIInChI=1S/C11H19NO2/c13-9-11(3-5-14-6-4-11)12-7-10(8-12)1-2-10/h13H,1-9H2
InChIKeyVDBFNBVRKWOOIG-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.62
Rot. Bonds2

About [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol

[4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol (PubChem CID 106299445) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol
PubChem CID106299445
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name[4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol
SMILESOCC1(N2CC3(CC3)C2)CCOCC1
InChIInChI=1S/C11H19NO2/c13-9-11(3-5-14-6-4-11)12-7-10(8-12)1-2-10/h13H,1-9H2
InChIKeyVDBFNBVRKWOOIG-UHFFFAOYSA-N
XLogP0.62
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol?
The IUPAC name of [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol (CID 106299445) is [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol.
What is the SMILES notation for [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol?
The canonical SMILES for [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol is OCC1(N2CC3(CC3)C2)CCOCC1.
What is the InChIKey of [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol?
The InChIKey is VDBFNBVRKWOOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-9-11(3-5-14-6-4-11)12-7-10(8-12)1-2-10/h13H,1-9H2.
What are the key properties of [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol?
[4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol has a molecular weight of 197.28 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-azaspiro[2.3]hexan-5-yl)oxan-4-yl]methanol is sourced from PubChem (CID 106299445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).