4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid

C14H24N2O3 — CID 79384911

IUPAC4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
SMILESCCC1(C(=O)O)CCN(C(=O)C2CCNC2C)CC1
InChIInChI=1S/C14H24N2O3/c1-3-14(13(18)19)5-8-16(9-6-14)12(17)11-4-7-15-10(11)2/h10-11,15H,3-9H2,1-2H3,(H,18,19)
InChIKeyKFTAIBDWEULTEH-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.09
Rot. Bonds3

About 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid

4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid (PubChem CID 79384911) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
PubChem CID79384911
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
SMILESCCC1(C(=O)O)CCN(C(=O)C2CCNC2C)CC1
InChIInChI=1S/C14H24N2O3/c1-3-14(13(18)19)5-8-16(9-6-14)12(17)11-4-7-15-10(11)2/h10-11,15H,3-9H2,1-2H3,(H,18,19)
InChIKeyKFTAIBDWEULTEH-UHFFFAOYSA-N
XLogP1.09
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-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

3-ethyl-1-(2-methylpyrrolidine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 79383810
(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 81103357
4-ethyl-1-[(2R)-piperidine-2-carbonyl]piperidine-4-carboxylic acid
CID 104913902
4-ethyl-1-(4-ethylpiperidine-2-carbonyl)piperidine-4-carboxylic acid
CID 114428986
(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 107219562
N-ethyl-4-(2-methylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
CID 79389325
(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 102953558
3-ethyl-1-(2-methylpiperidine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 106740017
4-ethyl-1-[(3S)-piperidine-3-carbonyl]piperidine-4-carboxylic acid
CID 81141638
(2-methylpyrrolidin-3-yl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 79388557
(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone
CID 81115944
(3,5-dimethylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 79383471

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid?
The IUPAC name of 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid (CID 79384911) is 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid?
The canonical SMILES for 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid is CCC1(C(=O)O)CCN(C(=O)C2CCNC2C)CC1.
What is the InChIKey of 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid?
The InChIKey is KFTAIBDWEULTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-14(13(18)19)5-8-16(9-6-14)12(17)11-4-7-15-10(11)2/h10-11,15H,3-9H2,1-2H3,(H,18,19).
What are the key properties of 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid?
4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid has a molecular weight of 268.36 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 79384911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).