(2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid

C7H11NO3 — CID 59309467

IUPAC(2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid
SMILESCCN1C(=O)CC[C@@H]1C(=O)O
InChIInChI=1S/C7H11NO3/c1-2-8-5(7(10)11)3-4-6(8)9/h5H,2-4H2,1H3,(H,10,11)/t5-/m1/s1
InChIKeyAGWPBFFUIGQGJG-RXMQYKEDSA-N
MW157.17 g/mol
LogP0.08
Rot. Bonds2

About (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid

(2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid (PubChem CID 59309467) has the molecular formula C7H11NO3 and a molecular weight of 157.17 g/mol. Its IUPAC name is (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid
PubChem CID59309467
Molecular FormulaC7H11NO3
Molecular Weight157.17 g/mol
Exact Mass157.07
IUPAC Name(2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid
SMILESCCN1C(=O)CC[C@@H]1C(=O)O
InChIInChI=1S/C7H11NO3/c1-2-8-5(7(10)11)3-4-6(8)9/h5H,2-4H2,1H3,(H,10,11)/t5-/m1/s1
InChIKeyAGWPBFFUIGQGJG-RXMQYKEDSA-N
XLogP0.08
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-5-oxopyrrolidine-2-carboxylic acid
CID 19002576
1-heptyl-5-oxopyrrolidine-2-carboxylic acid
CID 19002593
methyl 1-ethyl-5-oxopyrrolidine-2-carboxylate
CID 67459237
1-[(4-methylcyclohexyl)methyl]-5-oxopyrrolidine-2-carboxylic acid
CID 103354754
5-oxo-1-(2-propylsulfonylethyl)pyrrolidine-2-carboxylic acid
CID 106726403
1-(2-butylsulfanylethyl)-5-oxopyrrolidine-2-carboxylic acid
CID 19370197
5-oxo-1-pent-3-ynylpyrrolidine-2-carboxylic acid
CID 104808350
1-[(5,5-dimethyloxolan-2-yl)methyl]-5-oxopyrrolidine-2-carboxylic acid
CID 116522331
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-oxopyrrolidine-2-carboxylic acid
CID 112590083
5-oxo-1-(3,3,3-trifluoropropyl)pyrrolidine-2-carboxylic acid
CID 64566108
5-ethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxo-1,5-diazacycloundecane-6-carboxylic acid
CID 110200326
1-ethyl-4-methyl-6-oxopiperidine-2-carboxylic acid
CID 130815234

Frequently Asked Questions

What is the IUPAC name of (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid?
The IUPAC name of (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid (CID 59309467) is (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid is CCN1C(=O)CC[C@@H]1C(=O)O.
What is the InChIKey of (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid?
The InChIKey is AGWPBFFUIGQGJG-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H11NO3/c1-2-8-5(7(10)11)3-4-6(8)9/h5H,2-4H2,1H3,(H,10,11)/t5-/m1/s1.
What are the key properties of (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid?
(2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid has a molecular weight of 157.17 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-ethyl-5-oxopyrrolidine-2-carboxylic acid is sourced from PubChem (CID 59309467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).