(2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate

C10H12N2O5 — CID 54530056

IUPAC(2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate
SMILESO=C(CN1CCCC1=O)On1c(O)ccc1O
InChIInChI=1S/C10H12N2O5/c13-7-2-1-5-11(7)6-10(16)17-12-8(14)3-4-9(12)15/h3-4,14-15H,1-2,5-6H2
InChIKeyYVWIWUBUMSZKEV-UHFFFAOYSA-N
MW240.21 g/mol
LogP-0.52
Rot. Bonds3

About (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate

(2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate (PubChem CID 54530056) has the molecular formula C10H12N2O5 and a molecular weight of 240.21 g/mol. Its IUPAC name is (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate.

Molecular Properties

Compound Name(2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate
PubChem CID54530056
Molecular FormulaC10H12N2O5
Molecular Weight240.21 g/mol
Exact Mass240.07
IUPAC Name(2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate
SMILESO=C(CN1CCCC1=O)On1c(O)ccc1O
InChIInChI=1S/C10H12N2O5/c13-7-2-1-5-11(7)6-10(16)17-12-8(14)3-4-9(12)15/h3-4,14-15H,1-2,5-6H2
InChIKeyYVWIWUBUMSZKEV-UHFFFAOYSA-N
XLogP-0.52
TPSA92.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2,5-Dihydroxypyrrol-1-yl) 3-(2,5-dioxopyrrol-1-yl)propanoate
CID 53720774
(2,5-Dihydroxypyrrol-1-yl) 4-(2,5-dioxopyrrol-1-yl)butanoate
CID 53902524
Bis(2,5-dihydroxypyrrol-1-yl) butanedioate
CID 54004295
(2,5-Dihydroxypyrrol-1-yl) butanoate
CID 54133325
(2,5-Dihydroxypyrrol-1-yl) 3-(2,5-dihydroxypyrrol-1-yl)propanoate
CID 54497013
(2,5-Dihydroxypyrrol-1-yl) 6-(2,5-dioxopyrrol-1-yl)hexanoate
CID 54539923
[4-(2,5-Dihydroxypyrrol-1-yl)oxy-4-oxobutyl]-trimethylazanium
CID 90703472
(2,5-Dihydroxypyrrol-1-yl) 2-[(2,2,2-trifluoroacetyl)amino]acetate
CID 90885722
1-O-tert-butyl 2-O-(2,5-dihydroxypyrrol-1-yl) (2S)-4-fluoropyrrolidine-1,2-dicarboxylate
CID 91291927
(2,5-Dihydroxypyrrol-1-yl) 4-[(2,2,2-trifluoroacetyl)amino]butanoate
CID 91465498
(2,5-Dihydroxypyrrol-1-yl) 2-(2-sulfanylpropanoylamino)acetate
CID 90935387
(2,5-Dioxopyrrol-1-yl) 2-(2,5-dihydroxypyrrol-1-yl)propanoate
CID 53638151

Frequently Asked Questions

What is the IUPAC name of (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate?
The IUPAC name of (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate (CID 54530056) is (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate.
What is the SMILES notation for (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate?
The canonical SMILES for (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate is O=C(CN1CCCC1=O)On1c(O)ccc1O.
What is the InChIKey of (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate?
The InChIKey is YVWIWUBUMSZKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O5/c13-7-2-1-5-11(7)6-10(16)17-12-8(14)3-4-9(12)15/h3-4,14-15H,1-2,5-6H2.
What are the key properties of (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate?
(2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate has a molecular weight of 240.21 g/mol, XLogP of -0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dihydroxypyrrol-1-yl) 2-(2-oxopyrrolidin-1-yl)acetate is sourced from PubChem (CID 54530056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).