5-oxo-2-phenyloxolane-3-carboxamide

C11H11NO3 — CID 25940

IUPAC5-oxo-2-phenyloxolane-3-carboxamide
SMILESNC(=O)C1CC(=O)OC1c1ccccc1
InChIInChI=1S/C11H11NO3/c12-11(14)8-6-9(13)15-10(8)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H2,12,14)
InChIKeyCLPIWJZJIQJXTP-UHFFFAOYSA-N
MW205.21 g/mol
LogP0.78
Rot. Bonds2

About 5-oxo-2-phenyloxolane-3-carboxamide

5-oxo-2-phenyloxolane-3-carboxamide (PubChem CID 25940) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 5-oxo-2-phenyloxolane-3-carboxamide.

Molecular Properties

Compound Name5-oxo-2-phenyloxolane-3-carboxamide
PubChem CID25940
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name5-oxo-2-phenyloxolane-3-carboxamide
SMILESNC(=O)C1CC(=O)OC1c1ccccc1
InChIInChI=1S/C11H11NO3/c12-11(14)8-6-9(13)15-10(8)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H2,12,14)
InChIKeyCLPIWJZJIQJXTP-UHFFFAOYSA-N
XLogP0.78
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-2-phenyloxolane-3-carboxamide?
The IUPAC name of 5-oxo-2-phenyloxolane-3-carboxamide (CID 25940) is 5-oxo-2-phenyloxolane-3-carboxamide.
What is the SMILES notation for 5-oxo-2-phenyloxolane-3-carboxamide?
The canonical SMILES for 5-oxo-2-phenyloxolane-3-carboxamide is NC(=O)C1CC(=O)OC1c1ccccc1.
What is the InChIKey of 5-oxo-2-phenyloxolane-3-carboxamide?
The InChIKey is CLPIWJZJIQJXTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c12-11(14)8-6-9(13)15-10(8)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H2,12,14).
What are the key properties of 5-oxo-2-phenyloxolane-3-carboxamide?
5-oxo-2-phenyloxolane-3-carboxamide has a molecular weight of 205.21 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-2-phenyloxolane-3-carboxamide is sourced from PubChem (CID 25940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).