2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide

C15H19NO4 — CID 3244745

IUPAC2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide
SMILESCOc1ccc(C2OC(=O)CC2C(=O)NC(C)C)cc1
InChIInChI=1S/C15H19NO4/c1-9(2)16-15(18)12-8-13(17)20-14(12)10-4-6-11(19-3)7-5-10/h4-7,9,12,14H,8H2,1-3H3,(H,16,18)
InChIKeyZVUNXGAXVMCAKL-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.82
Rot. Bonds4

About 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide

2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide (PubChem CID 3244745) has the molecular formula C15H19NO4 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide
PubChem CID3244745
Molecular FormulaC15H19NO4
Molecular Weight277.32 g/mol
Exact Mass277.13
IUPAC Name2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide
SMILESCOc1ccc(C2OC(=O)CC2C(=O)NC(C)C)cc1
InChIInChI=1S/C15H19NO4/c1-9(2)16-15(18)12-8-13(17)20-14(12)10-4-6-11(19-3)7-5-10/h4-7,9,12,14H,8H2,1-3H3,(H,16,18)
InChIKeyZVUNXGAXVMCAKL-UHFFFAOYSA-N
XLogP1.82
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide?
The IUPAC name of 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide (CID 3244745) is 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide?
The canonical SMILES for 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide is COc1ccc(C2OC(=O)CC2C(=O)NC(C)C)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide?
The InChIKey is ZVUNXGAXVMCAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO4/c1-9(2)16-15(18)12-8-13(17)20-14(12)10-4-6-11(19-3)7-5-10/h4-7,9,12,14H,8H2,1-3H3,(H,16,18).
What are the key properties of 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide?
2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide has a molecular weight of 277.32 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-oxo-N-propan-2-yloxolane-3-carboxamide is sourced from PubChem (CID 3244745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).