2-azaspiro[4.4]nonan-3-ylmethanol

C9H17NO — CID 105430375

IUPAC2-azaspiro[4.4]nonan-3-ylmethanol
SMILESOCC1CC2(CCCC2)CN1
InChIInChI=1S/C9H17NO/c11-6-8-5-9(7-10-8)3-1-2-4-9/h8,10-11H,1-7H2
InChIKeyVSXUEKKOQGVIRJ-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.90
Rot. Bonds1

About 2-azaspiro[4.4]nonan-3-ylmethanol

2-azaspiro[4.4]nonan-3-ylmethanol (PubChem CID 105430375) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-azaspiro[4.4]nonan-3-ylmethanol.

Molecular Properties

Compound Name2-azaspiro[4.4]nonan-3-ylmethanol
PubChem CID105430375
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-azaspiro[4.4]nonan-3-ylmethanol
SMILESOCC1CC2(CCCC2)CN1
InChIInChI=1S/C9H17NO/c11-6-8-5-9(7-10-8)3-1-2-4-9/h8,10-11H,1-7H2
InChIKeyVSXUEKKOQGVIRJ-UHFFFAOYSA-N
XLogP0.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.4]nonan-3-ylmethanol?
The IUPAC name of 2-azaspiro[4.4]nonan-3-ylmethanol (CID 105430375) is 2-azaspiro[4.4]nonan-3-ylmethanol.
What is the SMILES notation for 2-azaspiro[4.4]nonan-3-ylmethanol?
The canonical SMILES for 2-azaspiro[4.4]nonan-3-ylmethanol is OCC1CC2(CCCC2)CN1.
What is the InChIKey of 2-azaspiro[4.4]nonan-3-ylmethanol?
The InChIKey is VSXUEKKOQGVIRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c11-6-8-5-9(7-10-8)3-1-2-4-9/h8,10-11H,1-7H2.
What are the key properties of 2-azaspiro[4.4]nonan-3-ylmethanol?
2-azaspiro[4.4]nonan-3-ylmethanol has a molecular weight of 155.24 g/mol, XLogP of 0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.4]nonan-3-ylmethanol is sourced from PubChem (CID 105430375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).