4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid

C11H17N3O5 — CID 55033395

IUPAC4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid
SMILESO=C1NCCCC1NC(=O)N1CC(O)CC1C(=O)O
InChIInChI=1S/C11H17N3O5/c15-6-4-8(10(17)18)14(5-6)11(19)13-7-2-1-3-12-9(7)16/h6-8,15H,1-5H2,(H,12,16)(H,13,19)(H,17,18)
InChIKeyOSJFIHIRUGWLEE-UHFFFAOYSA-N
MW271.27 g/mol
LogP-1.51
Rot. Bonds2

About 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid

4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid (PubChem CID 55033395) has the molecular formula C11H17N3O5 and a molecular weight of 271.27 g/mol. Its IUPAC name is 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid
PubChem CID55033395
Molecular FormulaC11H17N3O5
Molecular Weight271.27 g/mol
Exact Mass271.12
IUPAC Name4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid
SMILESO=C1NCCCC1NC(=O)N1CC(O)CC1C(=O)O
InChIInChI=1S/C11H17N3O5/c15-6-4-8(10(17)18)14(5-6)11(19)13-7-2-1-3-12-9(7)16/h6-8,15H,1-5H2,(H,12,16)(H,13,19)(H,17,18)
InChIKeyOSJFIHIRUGWLEE-UHFFFAOYSA-N
XLogP-1.51
TPSA118.97 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 5-1.51
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1-(cyclopropylcarbamoyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 61187010
(2S,4R)-1-(cyclooctylcarbamoyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 63841825
2-methyl-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 79382968
(2S)-4-hydroxy-1-[(1-methyl-2-oxopyrrolidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 106257927
(3R)-1-[(2-oxopiperidin-3-yl)carbamoyl]piperidine-3-carboxylic acid
CID 81120603
(2S)-4-hydroxy-1-[(2-hydroxycyclohexyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 62358912
(2R,4R)-4-hydroxy-1-[(1-methyl-2,5-dioxopyrrolidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 79014069
(2S,4R)-4-hydroxy-1-[(2-methylcyclopropyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 63844255
(2S,4S)-1-(cyclopentylmethylcarbamoyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 64713739
3-[(2-oxopiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550647
(2R,4R)-4-hydroxy-1-[(2-methylcycloheptyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 79013678
(2S,4S)-4-hydroxy-1-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 64712230

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid?
The IUPAC name of 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid (CID 55033395) is 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid?
The canonical SMILES for 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid is O=C1NCCCC1NC(=O)N1CC(O)CC1C(=O)O.
What is the InChIKey of 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid?
The InChIKey is OSJFIHIRUGWLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O5/c15-6-4-8(10(17)18)14(5-6)11(19)13-7-2-1-3-12-9(7)16/h6-8,15H,1-5H2,(H,12,16)(H,13,19)(H,17,18).
What are the key properties of 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid?
4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid has a molecular weight of 271.27 g/mol, XLogP of -1.51, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-[(2-oxopiperidin-3-yl)carbamoyl]pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 55033395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).