[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate

C19H20N2O5 — CID 2497261

IUPAC[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate
SMILESCC(C)NC(=O)NC(=O)COC(=O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C19H20N2O5/c1-13(2)20-19(24)21-17(22)12-25-18(23)15-10-6-7-11-16(15)26-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,20,21,22,24)
InChIKeyRHJIBUUROHFRBB-UHFFFAOYSA-N
MW356.38 g/mol
LogP2.87
Rot. Bonds6

About [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate

[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate (PubChem CID 2497261) has the molecular formula C19H20N2O5 and a molecular weight of 356.38 g/mol. Its IUPAC name is [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate.

Molecular Properties

Compound Name[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate
PubChem CID2497261
Molecular FormulaC19H20N2O5
Molecular Weight356.38 g/mol
Exact Mass356.14
IUPAC Name[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate
SMILESCC(C)NC(=O)NC(=O)COC(=O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C19H20N2O5/c1-13(2)20-19(24)21-17(22)12-25-18(23)15-10-6-7-11-16(15)26-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,20,21,22,24)
InChIKeyRHJIBUUROHFRBB-UHFFFAOYSA-N
XLogP2.87
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate?
The IUPAC name of [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate (CID 2497261) is [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate.
What is the SMILES notation for [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate?
The canonical SMILES for [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate is CC(C)NC(=O)NC(=O)COC(=O)c1ccccc1Oc1ccccc1.
What is the InChIKey of [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate?
The InChIKey is RHJIBUUROHFRBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5/c1-13(2)20-19(24)21-17(22)12-25-18(23)15-10-6-7-11-16(15)26-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,20,21,22,24).
What are the key properties of [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate?
[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate has a molecular weight of 356.38 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate is sourced from PubChem (CID 2497261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).