6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid

C9H13NO3 — CID 126847405

IUPAC6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid
SMILESO=C1CC2(CCC2)C(C(=O)O)CN1
InChIInChI=1S/C9H13NO3/c11-7-4-9(2-1-3-9)6(5-10-7)8(12)13/h6H,1-5H2,(H,10,11)(H,12,13)
InChIKeySCCKXDGLPPPUJF-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.38
Rot. Bonds1

About 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid

6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid (PubChem CID 126847405) has the molecular formula C9H13NO3 and a molecular weight of 183.21 g/mol. Its IUPAC name is 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid.

Molecular Properties

Compound Name6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid
PubChem CID126847405
Molecular FormulaC9H13NO3
Molecular Weight183.21 g/mol
Exact Mass183.09
IUPAC Name6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid
SMILESO=C1CC2(CCC2)C(C(=O)O)CN1
InChIInChI=1S/C9H13NO3/c11-7-4-9(2-1-3-9)6(5-10-7)8(12)13/h6H,1-5H2,(H,10,11)(H,12,13)
InChIKeySCCKXDGLPPPUJF-UHFFFAOYSA-N
XLogP0.38
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-hydroxy-3-azaspiro[5.5]undecan-2-one
CID 165468946
8-azaspiro[4.5]decane-10-carboxylic acid
CID 91278637
spiro[3.4]octane-8-carboxylic acid
CID 83905140
(8S)-7-oxo-6-azaspiro[3.4]octane-8-carboxylic acid
CID 129388763
N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide
CID 166297885
(5R,9S)-9-methyl-2-azaspiro[4.4]nonan-3-one
CID 97030978
6-oxo-5-oxaspiro[3.4]octane-8-carboxylic acid
CID 166444205
(2R)-spiro[2.5]octane-2-carboxylic acid
CID 10419388
6,8-dioxospiro[3.5]nonane-9-carboxylic acid
CID 21133242
3-oxo-2-azaspiro[4.5]decane-4-carboxylic acid
CID 19354262
spiro[5.6]dodecane-12-carboxylic acid
CID 59513338
2-[1-[(5-oxopyrrolidine-3-carbonyl)amino]cyclobutyl]acetic acid
CID 83191868

Frequently Asked Questions

What is the IUPAC name of 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid?
The IUPAC name of 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid (CID 126847405) is 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid.
What is the SMILES notation for 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid?
The canonical SMILES for 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid is O=C1CC2(CCC2)C(C(=O)O)CN1.
What is the InChIKey of 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid?
The InChIKey is SCCKXDGLPPPUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3/c11-7-4-9(2-1-3-9)6(5-10-7)8(12)13/h6H,1-5H2,(H,10,11)(H,12,13).
What are the key properties of 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid?
6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid has a molecular weight of 183.21 g/mol, XLogP of 0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid is sourced from PubChem (CID 126847405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).