7-azoniaspiro[3.5]nonan-8-ylmethanol

C9H18NO+ — CID 163482447

IUPAC7-azoniaspiro[3.5]nonan-8-ylmethanol
SMILESOCC1CC2(CCC2)CC[NH2+]1
InChIInChI=1S/C9H17NO/c11-7-8-6-9(2-1-3-9)4-5-10-8/h8,10-11H,1-7H2/p+1
InChIKeyCFSLKAPFSPMYNP-UHFFFAOYSA-O
MW156.25 g/mol
LogP-0.13
Rot. Bonds1

About 7-azoniaspiro[3.5]nonan-8-ylmethanol

7-azoniaspiro[3.5]nonan-8-ylmethanol (PubChem CID 163482447) has the molecular formula C9H18NO+ and a molecular weight of 156.25 g/mol. Its IUPAC name is 7-azoniaspiro[3.5]nonan-8-ylmethanol.

Molecular Properties

Compound Name7-azoniaspiro[3.5]nonan-8-ylmethanol
PubChem CID163482447
Molecular FormulaC9H18NO+
Molecular Weight156.25 g/mol
Exact Mass156.14
IUPAC Name7-azoniaspiro[3.5]nonan-8-ylmethanol
SMILESOCC1CC2(CCC2)CC[NH2+]1
InChIInChI=1S/C9H17NO/c11-7-8-6-9(2-1-3-9)4-5-10-8/h8,10-11H,1-7H2/p+1
InChIKeyCFSLKAPFSPMYNP-UHFFFAOYSA-O
XLogP-0.13
TPSA36.84 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-azoniaspiro[3.5]nonan-8-ylmethanol?
The IUPAC name of 7-azoniaspiro[3.5]nonan-8-ylmethanol (CID 163482447) is 7-azoniaspiro[3.5]nonan-8-ylmethanol.
What is the SMILES notation for 7-azoniaspiro[3.5]nonan-8-ylmethanol?
The canonical SMILES for 7-azoniaspiro[3.5]nonan-8-ylmethanol is OCC1CC2(CCC2)CC[NH2+]1.
What is the InChIKey of 7-azoniaspiro[3.5]nonan-8-ylmethanol?
The InChIKey is CFSLKAPFSPMYNP-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H17NO/c11-7-8-6-9(2-1-3-9)4-5-10-8/h8,10-11H,1-7H2/p+1.
What are the key properties of 7-azoniaspiro[3.5]nonan-8-ylmethanol?
7-azoniaspiro[3.5]nonan-8-ylmethanol has a molecular weight of 156.25 g/mol, XLogP of -0.13, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-azoniaspiro[3.5]nonan-8-ylmethanol is sourced from PubChem (CID 163482447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).