(2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid

C8H12N2O5 — CID 101466100

IUPAC(2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid
SMILESN[C@H](C[C@@]1(C(=O)O)CCC(=O)N1)C(=O)O
InChIInChI=1S/C8H12N2O5/c9-4(6(12)13)3-8(7(14)15)2-1-5(11)10-8/h4H,1-3,9H2,(H,10,11)(H,12,13)(H,14,15)/t4-,8-/m1/s1
InChIKeyNQZQCUYYRKZIAN-SPGJFGJESA-N
MW216.19 g/mol
LogP-1.48
Rot. Bonds4

About (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid

(2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid (PubChem CID 101466100) has the molecular formula C8H12N2O5 and a molecular weight of 216.19 g/mol. Its IUPAC name is (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid
PubChem CID101466100
Molecular FormulaC8H12N2O5
Molecular Weight216.19 g/mol
Exact Mass216.07
IUPAC Name(2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid
SMILESN[C@H](C[C@@]1(C(=O)O)CCC(=O)N1)C(=O)O
InChIInChI=1S/C8H12N2O5/c9-4(6(12)13)3-8(7(14)15)2-1-5(11)10-8/h4H,1-3,9H2,(H,10,11)(H,12,13)(H,14,15)/t4-,8-/m1/s1
InChIKeyNQZQCUYYRKZIAN-SPGJFGJESA-N
XLogP-1.48
TPSA129.72 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.19
LogP ≤ 5-1.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid with MolForge

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Related Compounds

ethyl 2-ethyl-5-oxopyrrolidine-2-carboxylate
CID 58405373
(2S)-2-amino-3-(1-methylcyclopropyl)propanoic acid;hydrochloride
CID 155270918
(2S)-2-aminobutanedioic acid;(2S)-2,4-diamino-4-oxobutanoic acid;pyrrolidine-2,5-dione
CID 69442862
2-amino-3-(1-bicyclo[2.2.2]octanyl)propanoic acid
CID 130806109
(2S)-2-amino-3-[(3S)-2,5-dioxopyrrolidin-3-yl]propanoic acid
CID 10330059
(2S)-2-amino-3-(4-oxopiperidin-1-yl)propanoic acid
CID 138475703
(2S)-2-amino-6-(2,4-dioxo-1,3-diazinan-1-yl)hexanoic acid
CID 101112605
(2S)-2-amino-3-(2,5-dioxopyrrolidin-3-yl)sulfanylpropanoic acid
CID 118343597
ethyl 2-but-3-enyl-5-oxopyrrolidine-2-carboxylate
CID 154676193
2-amino-3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoic acid
CID 106528110
(2S)-2-amino-3-hydroxypropanoic acid;pyrrole-2,5-dione
CID 160632774
7-oxoazepane-2,2-dicarboxamide
CID 135799851

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid?
The IUPAC name of (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid (CID 101466100) is (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid?
The canonical SMILES for (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid is N[C@H](C[C@@]1(C(=O)O)CCC(=O)N1)C(=O)O.
What is the InChIKey of (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid?
The InChIKey is NQZQCUYYRKZIAN-SPGJFGJESA-N. The full InChI is InChI=1S/C8H12N2O5/c9-4(6(12)13)3-8(7(14)15)2-1-5(11)10-8/h4H,1-3,9H2,(H,10,11)(H,12,13)(H,14,15)/t4-,8-/m1/s1.
What are the key properties of (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid?
(2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid has a molecular weight of 216.19 g/mol, XLogP of -1.48, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2R)-2-amino-2-carboxyethyl]-5-oxopyrrolidine-2-carboxylic acid is sourced from PubChem (CID 101466100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).