(2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid

C12H20N2O3 — CID 79854851

IUPAC(2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid
SMILESNC1(CC(=O)N2CCCC[C@@H]2C(=O)O)CCC1
InChIInChI=1S/C12H20N2O3/c13-12(5-3-6-12)8-10(15)14-7-2-1-4-9(14)11(16)17/h9H,1-8,13H2,(H,16,17)/t9-/m1/s1
InChIKeyZJIQJUWUGOGWGL-SECBINFHSA-N
MW240.30 g/mol
LogP0.72
Rot. Bonds3

About (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid

(2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid (PubChem CID 79854851) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid
PubChem CID79854851
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name(2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid
SMILESNC1(CC(=O)N2CCCC[C@@H]2C(=O)O)CCC1
InChIInChI=1S/C12H20N2O3/c13-12(5-3-6-12)8-10(15)14-7-2-1-4-9(14)11(16)17/h9H,1-8,13H2,(H,16,17)/t9-/m1/s1
InChIKeyZJIQJUWUGOGWGL-SECBINFHSA-N
XLogP0.72
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-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

(2R)-1-[2-(1-aminocyclohexyl)acetyl]pyrrolidine-2-carboxylic acid
CID 64677043
1-[2-[1-(aminomethyl)cyclobutyl]acetyl]azepane-2-carboxylic acid
CID 81169332
(2R)-1-[2-[1-(aminomethyl)cyclohexyl]acetyl]piperidine-2-carboxylic acid
CID 103871056
(2R)-1-(2-aminoacetyl)piperidine-2-carboxylic acid
CID 79034620
2-(1-aminocyclobutyl)-1-(2-methylazepan-1-yl)ethanone
CID 79854226
1-(3-aminopropanoyl)azepane-2-carboxylic acid
CID 64564266
(2R)-1-[2-(3,3-difluorocyclohexyl)acetyl]piperidine-2-carboxylic acid
CID 155956904
1-(2-pyrrolidin-1-ylacetyl)piperidine-2-carboxylic acid
CID 68753456
(2S)-1-(2-aminoacetyl)pyrrolidine-2-carboxylic acid;hydrochloride
CID 68940110
2-(1-aminocyclohexyl)-1-(2-ethylazepan-1-yl)ethanone
CID 104689647
2-(1-aminocyclopentyl)-1-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 64684748
(2R)-1-(2-methoxyacetyl)piperidine-2-carboxylic acid
CID 30046872

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid?
The IUPAC name of (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid (CID 79854851) is (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid is NC1(CC(=O)N2CCCC[C@@H]2C(=O)O)CCC1.
What is the InChIKey of (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid?
The InChIKey is ZJIQJUWUGOGWGL-SECBINFHSA-N. The full InChI is InChI=1S/C12H20N2O3/c13-12(5-3-6-12)8-10(15)14-7-2-1-4-9(14)11(16)17/h9H,1-8,13H2,(H,16,17)/t9-/m1/s1.
What are the key properties of (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid?
(2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid has a molecular weight of 240.30 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(1-aminocyclobutyl)acetyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 79854851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).