2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid

C6H9NO4 — CID 11126541

IUPAC2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid
SMILESO=C(O)CN1CC(O)CC1=O
InChIInChI=1S/C6H9NO4/c8-4-1-5(9)7(2-4)3-6(10)11/h4,8H,1-3H2,(H,10,11)
InChIKeyBMOXYLBGPIDAAN-UHFFFAOYSA-N
MW159.14 g/mol
LogP-1.34
Rot. Bonds2

About 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid

2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid (PubChem CID 11126541) has the molecular formula C6H9NO4 and a molecular weight of 159.14 g/mol. Its IUPAC name is 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid
PubChem CID11126541
Molecular FormulaC6H9NO4
Molecular Weight159.14 g/mol
Exact Mass159.05
IUPAC Name2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid
SMILESO=C(O)CN1CC(O)CC1=O
InChIInChI=1S/C6H9NO4/c8-4-1-5(9)7(2-4)3-6(10)11/h4,8H,1-3H2,(H,10,11)
InChIKeyBMOXYLBGPIDAAN-UHFFFAOYSA-N
XLogP-1.34
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid?
The IUPAC name of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid (CID 11126541) is 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid.
What is the SMILES notation for 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid?
The canonical SMILES for 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid is O=C(O)CN1CC(O)CC1=O.
What is the InChIKey of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid?
The InChIKey is BMOXYLBGPIDAAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO4/c8-4-1-5(9)7(2-4)3-6(10)11/h4,8H,1-3H2,(H,10,11).
What are the key properties of 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid?
2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid has a molecular weight of 159.14 g/mol, XLogP of -1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetic acid is sourced from PubChem (CID 11126541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).