4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid

C11H20N2O3 — CID 134341510

IUPAC4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid
SMILESCC1CNCCC1N1CC(O)CC1C(=O)O
InChIInChI=1S/C11H20N2O3/c1-7-5-12-3-2-9(7)13-6-8(14)4-10(13)11(15)16/h7-10,12,14H,2-6H2,1H3,(H,15,16)
InChIKeyRWRNFTNARAKUQN-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.50
Rot. Bonds2

About 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid

4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid (PubChem CID 134341510) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid
PubChem CID134341510
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid
SMILESCC1CNCCC1N1CC(O)CC1C(=O)O
InChIInChI=1S/C11H20N2O3/c1-7-5-12-3-2-9(7)13-6-8(14)4-10(13)11(15)16/h7-10,12,14H,2-6H2,1H3,(H,15,16)
InChIKeyRWRNFTNARAKUQN-UHFFFAOYSA-N
XLogP-0.50
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-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)-2-[(2S)-1-(3-methylpiperidin-4-yl)pyrrolidin-2-yl]cyclopropane-1-carboxylic acid
CID 134324824
2,3,5-trimethyl-1-(3-methylpiperidin-4-yl)piperidine
CID 114593551
4-hydroxy-1-(3-methylcyclohexyl)pyrrolidine-2-carboxylic acid
CID 114351561
(2S,4R)-1-cyclohexyl-4-hydroxypyrrolidine-2-carboxylic acid
CID 67775431
1-methyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[3,2-c]pyridine-2-carboxylic acid
CID 83817362
(2S,4R)-4-hydroxy-1-(piperidine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 63843186
(3R,4S)-3-methylpiperidine-4-carboxylic acid;hydrochloride
CID 126970561
3-[1-[(3R,4S)-3-methylpiperidin-4-yl]pyrrolidin-2-yl]propanoic acid
CID 134339511
(2S,4S)-4-hydroxy-1-[(3R)-piperidine-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 81134398
(2S,4R)-4-hydroxy-1-(oxan-4-yl)pyrrolidine-2-carboxylic acid
CID 67774938
(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid
CID 174738513
(2R,4R)-4-hydroxy-1-(2-methyl-2-piperidin-3-ylpropanoyl)pyrrolidine-2-carboxylic acid
CID 83199631

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid?
The IUPAC name of 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid (CID 134341510) is 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid is CC1CNCCC1N1CC(O)CC1C(=O)O.
What is the InChIKey of 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid?
The InChIKey is RWRNFTNARAKUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-7-5-12-3-2-9(7)13-6-8(14)4-10(13)11(15)16/h7-10,12,14H,2-6H2,1H3,(H,15,16).
What are the key properties of 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid?
4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid has a molecular weight of 228.29 g/mol, XLogP of -0.50, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(3-methylpiperidin-4-yl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 134341510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).