2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid

C13H21NO2 — CID 79695007

IUPAC2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1N1CC2(CCCC2)C1
InChIInChI=1S/C13H21NO2/c15-12(16)10-4-3-5-11(10)14-8-13(9-14)6-1-2-7-13/h10-11H,1-9H2,(H,15,16)
InChIKeyOLEPDNLLHGDYRK-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.12
Rot. Bonds2

About 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid

2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid (PubChem CID 79695007) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid
PubChem CID79695007
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1N1CC2(CCCC2)C1
InChIInChI=1S/C13H21NO2/c15-12(16)10-4-3-5-11(10)14-8-13(9-14)6-1-2-7-13/h10-11H,1-9H2,(H,15,16)
InChIKeyOLEPDNLLHGDYRK-UHFFFAOYSA-N
XLogP2.12
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-oxa-2-azaspiro[3.5]nonan-2-yl)cyclopentane-1-carboxylic acid
CID 79694800
2-(8-azaspiro[4.5]decan-8-yl)cycloheptane-1-carboxylic acid
CID 63161343
2-(3,3-dimethylazetidin-1-yl)cyclohexane-1-carboxylic acid
CID 79695533
1,2,3,5,6,7,8,8a-octahydroindolizine-8-carboxylic acid
CID 75987984
2-(2,2,6,6-tetramethylmorpholin-4-yl)cycloheptane-1-carboxylic acid
CID 102746280
(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylic acid
CID 7758382
2-(4-methylpiperazin-1-yl)cyclopentane-1-carboxylic acid
CID 63069445
3-(2-azaspiro[3.5]nonan-2-yl)cyclohexane-1-carboxylic acid
CID 79694969
2-(3,4,5-trimethylpiperazin-1-yl)cyclopentane-1-carboxylic acid
CID 114540602
2-(8-azaspiro[4.5]decan-8-yl)-4-methylcyclohexane-1-carboxylic acid
CID 63161385
2-(4,4-dimethylazepan-1-yl)cycloheptane-1-carboxylic acid
CID 65286391
2-(3-hydroxypiperidin-1-yl)cyclopentane-1-carboxylic acid
CID 83821308

Frequently Asked Questions

What is the IUPAC name of 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid (CID 79695007) is 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid is O=C(O)C1CCCC1N1CC2(CCCC2)C1.
What is the InChIKey of 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid?
The InChIKey is OLEPDNLLHGDYRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c15-12(16)10-4-3-5-11(10)14-8-13(9-14)6-1-2-7-13/h10-11H,1-9H2,(H,15,16).
What are the key properties of 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid?
2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid has a molecular weight of 223.32 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-azaspiro[3.4]octan-2-yl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 79695007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).