[(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid

C14H23N3O6 — CID 69153138

IUPAC[(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid
SMILESCO[C@H](C)[C@@H](C(=O)N1CCOCC1)N1CC[C@H](NC(=O)O)C1=O
InChIInChI=1S/C14H23N3O6/c1-9(22-2)11(13(19)16-5-7-23-8-6-16)17-4-3-10(12(17)18)15-14(20)21/h9-11,15H,3-8H2,1-2H3,(H,20,21)/t9-,10+,11+/m1/s1
InChIKeyYSNZUJIXZJOZKL-VWYCJHECSA-N
MW329.35 g/mol
LogP-0.88
Rot. Bonds5

About [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid

[(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid (PubChem CID 69153138) has the molecular formula C14H23N3O6 and a molecular weight of 329.35 g/mol. Its IUPAC name is [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid.

Molecular Properties

Compound Name[(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid
PubChem CID69153138
Molecular FormulaC14H23N3O6
Molecular Weight329.35 g/mol
Exact Mass329.16
IUPAC Name[(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid
SMILESCO[C@H](C)[C@@H](C(=O)N1CCOCC1)N1CC[C@H](NC(=O)O)C1=O
InChIInChI=1S/C14H23N3O6/c1-9(22-2)11(13(19)16-5-7-23-8-6-16)17-4-3-10(12(17)18)15-14(20)21/h9-11,15H,3-8H2,1-2H3,(H,20,21)/t9-,10+,11+/m1/s1
InChIKeyYSNZUJIXZJOZKL-VWYCJHECSA-N
XLogP-0.88
TPSA108.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.35
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid?
The IUPAC name of [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid (CID 69153138) is [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid.
What is the SMILES notation for [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid?
The canonical SMILES for [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid is CO[C@H](C)[C@@H](C(=O)N1CCOCC1)N1CC[C@H](NC(=O)O)C1=O.
What is the InChIKey of [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid?
The InChIKey is YSNZUJIXZJOZKL-VWYCJHECSA-N. The full InChI is InChI=1S/C14H23N3O6/c1-9(22-2)11(13(19)16-5-7-23-8-6-16)17-4-3-10(12(17)18)15-14(20)21/h9-11,15H,3-8H2,1-2H3,(H,20,21)/t9-,10+,11+/m1/s1.
What are the key properties of [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid?
[(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid has a molecular weight of 329.35 g/mol, XLogP of -0.88, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-1-[(2S,3R)-3-methoxy-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]carbamic acid is sourced from PubChem (CID 69153138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).