1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid

C10H15NO4 — CID 16775594

IUPAC1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
SMILESO=C(O)C1CC(O)CN1C(=O)C1CCC1
InChIInChI=1S/C10H15NO4/c12-7-4-8(10(14)15)11(5-7)9(13)6-2-1-3-6/h6-8,12H,1-5H2,(H,14,15)
InChIKeyZYGQRQFFEDJGAL-UHFFFAOYSA-N
MW213.23 g/mol
LogP-0.17
Rot. Bonds2

About 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid

1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid (PubChem CID 16775594) has the molecular formula C10H15NO4 and a molecular weight of 213.23 g/mol. Its IUPAC name is 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
PubChem CID16775594
Molecular FormulaC10H15NO4
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
SMILESO=C(O)C1CC(O)CN1C(=O)C1CCC1
InChIInChI=1S/C10H15NO4/c12-7-4-8(10(14)15)11(5-7)9(13)6-2-1-3-6/h6-8,12H,1-5H2,(H,14,15)
InChIKeyZYGQRQFFEDJGAL-UHFFFAOYSA-N
XLogP-0.17
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4S)-1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 30046185
(2S,4R)-1-(cycloheptanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 55262089
(2S,4R)-4-hydroxy-1-(piperidine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 63843186
(2S,4S)-4-hydroxy-1-[(3R)-piperidine-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 81134398
(2R,4R)-1-(cyclohex-3-ene-1-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 79000761
(2R,4R)-4-hydroxy-1-(2-methylcyclopentanecarbonyl)pyrrolidine-2-carboxylic acid
CID 107175592
(2S)-4-hydroxy-1-(1-methylsulfonylpiperidine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 61151967
1-(4-butylcyclohexanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 43184481
(2R,4R)-1-(2-aminocyclohexanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 79001244
(2S,4R)-4-hydroxy-1-(piperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 63844034
(2S,4S)-4-hydroxy-1-(5-oxopyrrolidine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 83192599
1-(2,3-dihydro-1H-indene-2-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 106892310

Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid?
The IUPAC name of 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid (CID 16775594) is 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid.
What is the SMILES notation for 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid?
The canonical SMILES for 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid is O=C(O)C1CC(O)CN1C(=O)C1CCC1.
What is the InChIKey of 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid?
The InChIKey is ZYGQRQFFEDJGAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4/c12-7-4-8(10(14)15)11(5-7)9(13)6-2-1-3-6/h6-8,12H,1-5H2,(H,14,15).
What are the key properties of 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid?
1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid has a molecular weight of 213.23 g/mol, XLogP of -0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid is sourced from PubChem (CID 16775594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).