1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid

C11H20N2O2 — CID 65053957

IUPAC1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid
SMILESCN1CCC(N2CCCCC2C(=O)O)C1
InChIInChI=1S/C11H20N2O2/c1-12-7-5-9(8-12)13-6-3-2-4-10(13)11(14)15/h9-10H,2-8H2,1H3,(H,14,15)
InChIKeyGFIUZYATJWMAMA-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.63
Rot. Bonds2

About 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid

1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid (PubChem CID 65053957) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid
PubChem CID65053957
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid
SMILESCN1CCC(N2CCCCC2C(=O)O)C1
InChIInChI=1S/C11H20N2O2/c1-12-7-5-9(8-12)13-6-3-2-4-10(13)11(14)15/h9-10H,2-8H2,1H3,(H,14,15)
InChIKeyGFIUZYATJWMAMA-UHFFFAOYSA-N
XLogP0.63
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-methylpyrrolidin-3-yl)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

(2S)-1-(1-methylpyrrolidin-3-yl)pyrrolidine-2-carboxylic acid
CID 83618259
(2S)-1-(1-methylpiperidin-4-yl)piperidine-2-carboxylic acid
CID 68690983
(2S)-1-(1-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid
CID 51892046
1-(1-methylazepan-4-yl)azepane-2-carboxylic acid
CID 65072667
1-(1-methylazepan-4-yl)pyrrolidine-2-carboxylic acid
CID 65073070
1-(1-propan-2-ylpyrrolidin-3-yl)azepane-2-carboxylic acid
CID 65069569
(2R)-1-[(3R,4S)-1,3-dimethylpiperidin-4-yl]pyrrolidine-2-carboxylic acid
CID 51980118
1-(3,5-dimethylcyclohexyl)piperidine-2-carboxylic acid
CID 64731455
1-(1-tert-butylazetidin-3-yl)pyrrolidine-2-carboxylic acid
CID 142538602
1,2,3,5,6,7,8,8a-octahydroindolizine-3-carboxylic acid;hydrochloride
CID 126796367
(2S)-1-cyclohexylpyrrolidine-2-carboxylic acid;hydrochloride
CID 141195485
1-piperidin-4-ylpiperidine-2-carboxylic acid
CID 21098979

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid?
The IUPAC name of 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid (CID 65053957) is 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid.
What is the SMILES notation for 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid?
The canonical SMILES for 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid is CN1CCC(N2CCCCC2C(=O)O)C1.
What is the InChIKey of 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid?
The InChIKey is GFIUZYATJWMAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-12-7-5-9(8-12)13-6-3-2-4-10(13)11(14)15/h9-10H,2-8H2,1H3,(H,14,15).
What are the key properties of 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid?
1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid has a molecular weight of 212.29 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrrolidin-3-yl)piperidine-2-carboxylic acid is sourced from PubChem (CID 65053957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).