(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid

C15H26N2O3 — CID 79034494

IUPAC(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid
SMILESCC1CCC(C)N1C(C)C(=O)N1CCCC[C@@H]1C(=O)O
InChIInChI=1S/C15H26N2O3/c1-10-7-8-11(2)17(10)12(3)14(18)16-9-5-4-6-13(16)15(19)20/h10-13H,4-9H2,1-3H3,(H,19,20)/t10?,11?,12?,13-/m1/s1
InChIKeyJOCZCQPGDVFGKE-NODFVKRRSA-N
MW282.38 g/mol
LogP1.71
Rot. Bonds3

About (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid

(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid (PubChem CID 79034494) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid
PubChem CID79034494
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid
SMILESCC1CCC(C)N1C(C)C(=O)N1CCCC[C@@H]1C(=O)O
InChIInChI=1S/C15H26N2O3/c1-10-7-8-11(2)17(10)12(3)14(18)16-9-5-4-6-13(16)15(19)20/h10-13H,4-9H2,1-3H3,(H,19,20)/t10?,11?,12?,13-/m1/s1
InChIKeyJOCZCQPGDVFGKE-NODFVKRRSA-N
XLogP1.71
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]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

1-[(2R)-2-aminopropanoyl]azepane-2-carboxylic acid
CID 78996683
1-(2-aminopropanoyl)azepane-2-carboxylic acid
CID 64564461
(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid
CID 83146744
(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 12718469
(2R)-1-(2-methylsulfonylpropanoyl)piperidine-2-carboxylic acid
CID 103953818
1-(2-amino-3-methylbutanoyl)azepane-2-carboxylic acid
CID 64562703
(2S)-1-(2,2-difluoroacetyl)piperidine-2-carboxylic acid
CID 103513364
1-(2-hydroxypropanoyl)pyrrolidine-2-carboxylic acid
CID 12919062
1-acetylpiperidine-2-carboxylic acid;ethane
CID 144674830
(2S)-1-[2-(carbamoylamino)-3-methylbutanoyl]piperidine-2-carboxylic acid
CID 66263553
(2R)-1-[3-(cyclohexanecarbonylamino)butanoyl]pyrrolidine-2-carboxylic acid
CID 119371105
(2R)-1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid
CID 23423034

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid?
The IUPAC name of (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid (CID 79034494) is (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid is CC1CCC(C)N1C(C)C(=O)N1CCCC[C@@H]1C(=O)O.
What is the InChIKey of (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid?
The InChIKey is JOCZCQPGDVFGKE-NODFVKRRSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-10-7-8-11(2)17(10)12(3)14(18)16-9-5-4-6-13(16)15(19)20/h10-13H,4-9H2,1-3H3,(H,19,20)/t10?,11?,12?,13-/m1/s1.
What are the key properties of (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid?
(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid has a molecular weight of 282.38 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 79034494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).