1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one

C10H16N2O4 — CID 534360

IUPAC1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one
SMILESO=C1CCCN1C(O)C(O)N1CCCC1=O
InChIInChI=1S/C10H16N2O4/c13-7-3-1-5-11(7)9(15)10(16)12-6-2-4-8(12)14/h9-10,15-16H,1-6H2
InChIKeyUXAHUJRTUDDBBC-UHFFFAOYSA-N
MW228.25 g/mol
LogP-1.13
Rot. Bonds3

About 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one

1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one (PubChem CID 534360) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one
PubChem CID534360
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Name1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one
SMILESO=C1CCCN1C(O)C(O)N1CCCC1=O
InChIInChI=1S/C10H16N2O4/c13-7-3-1-5-11(7)9(15)10(16)12-6-2-4-8(12)14/h9-10,15-16H,1-6H2
InChIKeyUXAHUJRTUDDBBC-UHFFFAOYSA-N
XLogP-1.13
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 5-1.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one (CID 534360) is 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one is O=C1CCCN1C(O)C(O)N1CCCC1=O.
What is the InChIKey of 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one?
The InChIKey is UXAHUJRTUDDBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c13-7-3-1-5-11(7)9(15)10(16)12-6-2-4-8(12)14/h9-10,15-16H,1-6H2.
What are the key properties of 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one?
1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one has a molecular weight of 228.25 g/mol, XLogP of -1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,2-dihydroxy-2-(2-oxopyrrolidin-1-yl)ethyl]pyrrolidin-2-one is sourced from PubChem (CID 534360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).