2-azaspiro[5.5]undecane-5-carboxylic acid

C11H19NO2 — CID 15521211

IUPAC2-azaspiro[5.5]undecane-5-carboxylic acid
SMILESO=C(O)C1CCNCC12CCCCC2
InChIInChI=1S/C11H19NO2/c13-10(14)9-4-7-12-8-11(9)5-2-1-3-6-11/h9,12H,1-8H2,(H,13,14)
InChIKeyVOIHUGOAAZRCIX-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.63
Rot. Bonds1

About 2-azaspiro[5.5]undecane-5-carboxylic acid

2-azaspiro[5.5]undecane-5-carboxylic acid (PubChem CID 15521211) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-azaspiro[5.5]undecane-5-carboxylic acid.

Molecular Properties

Compound Name2-azaspiro[5.5]undecane-5-carboxylic acid
PubChem CID15521211
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-azaspiro[5.5]undecane-5-carboxylic acid
SMILESO=C(O)C1CCNCC12CCCCC2
InChIInChI=1S/C11H19NO2/c13-10(14)9-4-7-12-8-11(9)5-2-1-3-6-11/h9,12H,1-8H2,(H,13,14)
InChIKeyVOIHUGOAAZRCIX-UHFFFAOYSA-N
XLogP1.63
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[5.5]undecane-5-carboxylic acid?
The IUPAC name of 2-azaspiro[5.5]undecane-5-carboxylic acid (CID 15521211) is 2-azaspiro[5.5]undecane-5-carboxylic acid.
What is the SMILES notation for 2-azaspiro[5.5]undecane-5-carboxylic acid?
The canonical SMILES for 2-azaspiro[5.5]undecane-5-carboxylic acid is O=C(O)C1CCNCC12CCCCC2.
What is the InChIKey of 2-azaspiro[5.5]undecane-5-carboxylic acid?
The InChIKey is VOIHUGOAAZRCIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-10(14)9-4-7-12-8-11(9)5-2-1-3-6-11/h9,12H,1-8H2,(H,13,14).
What are the key properties of 2-azaspiro[5.5]undecane-5-carboxylic acid?
2-azaspiro[5.5]undecane-5-carboxylic acid has a molecular weight of 197.28 g/mol, XLogP of 1.63, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[5.5]undecane-5-carboxylic acid is sourced from PubChem (CID 15521211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).