5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide

C11H17N3O4 — CID 110743126

IUPAC5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NCCCN2CCOC2=O)N1
InChIInChI=1S/C11H17N3O4/c15-9-3-2-8(13-9)10(16)12-4-1-5-14-6-7-18-11(14)17/h8H,1-7H2,(H,12,16)(H,13,15)
InChIKeyRBJABDDIFJDKJA-UHFFFAOYSA-N
MW255.27 g/mol
LogP-0.78
Rot. Bonds5

About 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide

5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide (PubChem CID 110743126) has the molecular formula C11H17N3O4 and a molecular weight of 255.27 g/mol. Its IUPAC name is 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide
PubChem CID110743126
Molecular FormulaC11H17N3O4
Molecular Weight255.27 g/mol
Exact Mass255.12
IUPAC Name5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NCCCN2CCOC2=O)N1
InChIInChI=1S/C11H17N3O4/c15-9-3-2-8(13-9)10(16)12-4-1-5-14-6-7-18-11(14)17/h8H,1-7H2,(H,12,16)(H,13,15)
InChIKeyRBJABDDIFJDKJA-UHFFFAOYSA-N
XLogP-0.78
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide?
The IUPAC name of 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide (CID 110743126) is 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide is O=C1CCC(C(=O)NCCCN2CCOC2=O)N1.
What is the InChIKey of 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide?
The InChIKey is RBJABDDIFJDKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4/c15-9-3-2-8(13-9)10(16)12-4-1-5-14-6-7-18-11(14)17/h8H,1-7H2,(H,12,16)(H,13,15).
What are the key properties of 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide?
5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide has a molecular weight of 255.27 g/mol, XLogP of -0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 110743126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).