2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane

C15H23N3O3 — CID 143480902

IUPAC2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane
SMILESC=C(N)CON1C(=O)c2ccccc2C1=O.CCC.CN
InChIInChI=1S/C11H10N2O3.C3H8.CH5N/c1-7(12)6-16-13-10(14)8-4-2-3-5-9(8)11(13)15;1-3-2;1-2/h2-5H,1,6,12H2;3H2,1-2H3;2H2,1H3
InChIKeyRUDPCEXJXXGOPH-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.68
Rot. Bonds3

About 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane

2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane (PubChem CID 143480902) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane.

Molecular Properties

Compound Name2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane
PubChem CID143480902
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane
SMILESC=C(N)CON1C(=O)c2ccccc2C1=O.CCC.CN
InChIInChI=1S/C11H10N2O3.C3H8.CH5N/c1-7(12)6-16-13-10(14)8-4-2-3-5-9(8)11(13)15;1-3-2;1-2/h2-5H,1,6,12H2;3H2,1-2H3;2H2,1H3
InChIKeyRUDPCEXJXXGOPH-UHFFFAOYSA-N
XLogP1.68
TPSA98.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane?
The IUPAC name of 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane (CID 143480902) is 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane.
What is the SMILES notation for 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane?
The canonical SMILES for 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane is C=C(N)CON1C(=O)c2ccccc2C1=O.CCC.CN.
What is the InChIKey of 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane?
The InChIKey is RUDPCEXJXXGOPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3.C3H8.CH5N/c1-7(12)6-16-13-10(14)8-4-2-3-5-9(8)11(13)15;1-3-2;1-2/h2-5H,1,6,12H2;3H2,1-2H3;2H2,1H3.
What are the key properties of 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane?
2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane has a molecular weight of 293.37 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoprop-2-enoxy)isoindole-1,3-dione;methanamine;propane is sourced from PubChem (CID 143480902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).