2-azaspiro[3.5]nonane-3-carboxylic acid

C9H15NO2 — CID 10219907

IUPAC2-azaspiro[3.5]nonane-3-carboxylic acid
SMILESO=C(O)C1NCC12CCCCC2
InChIInChI=1S/C9H15NO2/c11-8(12)7-9(6-10-7)4-2-1-3-5-9/h7,10H,1-6H2,(H,11,12)
InChIKeyFPFWJAOAPTZRDJ-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.99
Rot. Bonds1

About 2-azaspiro[3.5]nonane-3-carboxylic acid

2-azaspiro[3.5]nonane-3-carboxylic acid (PubChem CID 10219907) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 2-azaspiro[3.5]nonane-3-carboxylic acid.

Molecular Properties

Compound Name2-azaspiro[3.5]nonane-3-carboxylic acid
PubChem CID10219907
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name2-azaspiro[3.5]nonane-3-carboxylic acid
SMILESO=C(O)C1NCC12CCCCC2
InChIInChI=1S/C9H15NO2/c11-8(12)7-9(6-10-7)4-2-1-3-5-9/h7,10H,1-6H2,(H,11,12)
InChIKeyFPFWJAOAPTZRDJ-UHFFFAOYSA-N
XLogP0.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[3.5]nonane-3-carboxylic acid?
The IUPAC name of 2-azaspiro[3.5]nonane-3-carboxylic acid (CID 10219907) is 2-azaspiro[3.5]nonane-3-carboxylic acid.
What is the SMILES notation for 2-azaspiro[3.5]nonane-3-carboxylic acid?
The canonical SMILES for 2-azaspiro[3.5]nonane-3-carboxylic acid is O=C(O)C1NCC12CCCCC2.
What is the InChIKey of 2-azaspiro[3.5]nonane-3-carboxylic acid?
The InChIKey is FPFWJAOAPTZRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c11-8(12)7-9(6-10-7)4-2-1-3-5-9/h7,10H,1-6H2,(H,11,12).
What are the key properties of 2-azaspiro[3.5]nonane-3-carboxylic acid?
2-azaspiro[3.5]nonane-3-carboxylic acid has a molecular weight of 169.22 g/mol, XLogP of 0.99, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[3.5]nonane-3-carboxylic acid is sourced from PubChem (CID 10219907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).