(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid

C8H14N2O4 — CID 168698683

IUPAC(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid
SMILESC[C@H](O)[C@H](C(=O)O)N1CC(N)CC1=O
InChIInChI=1S/C8H14N2O4/c1-4(11)7(8(13)14)10-3-5(9)2-6(10)12/h4-5,7,11H,2-3,9H2,1H3,(H,13,14)/t4-,5?,7+/m0/s1
InChIKeyYUZYPSWLMVUBNN-RMIHLSNLSA-N
MW202.21 g/mol
LogP-1.62
Rot. Bonds3

About (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid

(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid (PubChem CID 168698683) has the molecular formula C8H14N2O4 and a molecular weight of 202.21 g/mol. Its IUPAC name is (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid.

Molecular Properties

Compound Name(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid
PubChem CID168698683
Molecular FormulaC8H14N2O4
Molecular Weight202.21 g/mol
Exact Mass202.10
IUPAC Name(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid
SMILESC[C@H](O)[C@H](C(=O)O)N1CC(N)CC1=O
InChIInChI=1S/C8H14N2O4/c1-4(11)7(8(13)14)10-3-5(9)2-6(10)12/h4-5,7,11H,2-3,9H2,1H3,(H,13,14)/t4-,5?,7+/m0/s1
InChIKeyYUZYPSWLMVUBNN-RMIHLSNLSA-N
XLogP-1.62
TPSA103.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 5-1.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-methylbutanoic acid
CID 168698750
3-hydroxy-2-[2-oxo-4-(sulfanylmethyl)pyrrolidin-1-yl]butanoic acid
CID 168669110
3-hydroxy-2-(2-oxo-4-sulfamoylpyrrolidin-1-yl)butanoic acid
CID 168716351
(2S,3S)-2-(4-fluorosulfonyl-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid
CID 168713040
4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one
CID 131038054
(2R)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-sulfanylpropanoic acid
CID 168698989
2-(4-amino-2-oxopyrrolidin-1-yl)-2-(4-methoxyphenyl)acetic acid
CID 168698845
(2R,3S)-2-[4-(chloromethyl)-2-oxopyrrolidin-1-yl]-3-methylpentanoic acid
CID 168506448
(2R,3S)-3-methyl-2-[2-oxo-4-(sulfamoylmethyl)pyrrolidin-1-yl]pentanoic acid
CID 168680118
(2S)-3-methyl-2-(2-oxo-4-sulfamoylpyrrolidin-1-yl)butanoic acid
CID 168716442
3-methyl-2-(2-oxo-4-sulfamoylpyrrolidin-1-yl)butanoic acid
CID 168716429
2-(4-hydroxy-2-oxopyrrolidin-1-yl)-3-methylpentanoic acid
CID 168701417

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid?
The IUPAC name of (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid (CID 168698683) is (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid.
What is the SMILES notation for (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid?
The canonical SMILES for (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid is C[C@H](O)[C@H](C(=O)O)N1CC(N)CC1=O.
What is the InChIKey of (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid?
The InChIKey is YUZYPSWLMVUBNN-RMIHLSNLSA-N. The full InChI is InChI=1S/C8H14N2O4/c1-4(11)7(8(13)14)10-3-5(9)2-6(10)12/h4-5,7,11H,2-3,9H2,1H3,(H,13,14)/t4-,5?,7+/m0/s1.
What are the key properties of (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid?
(2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid has a molecular weight of 202.21 g/mol, XLogP of -1.62, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-(4-amino-2-oxopyrrolidin-1-yl)-3-hydroxybutanoic acid is sourced from PubChem (CID 168698683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).