3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane

C19H23NO2 — CID 142067637

IUPAC3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane
SMILESC=CC1=C(C=C)C(=O)N(C(C)Cc2ccccc2)C1=O.CC
InChIInChI=1S/C17H17NO2.C2H6/c1-4-14-15(5-2)17(20)18(16(14)19)12(3)11-13-9-7-6-8-10-13;1-2/h4-10,12H,1-2,11H2,3H3;1-2H3
InChIKeyHHPYHKOVLQCXES-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.68
Rot. Bonds5

About 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane

3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane (PubChem CID 142067637) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane.

Molecular Properties

Compound Name3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane
PubChem CID142067637
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane
SMILESC=CC1=C(C=C)C(=O)N(C(C)Cc2ccccc2)C1=O.CC
InChIInChI=1S/C17H17NO2.C2H6/c1-4-14-15(5-2)17(20)18(16(14)19)12(3)11-13-9-7-6-8-10-13;1-2/h4-10,12H,1-2,11H2,3H3;1-2H3
InChIKeyHHPYHKOVLQCXES-UHFFFAOYSA-N
XLogP3.68
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane?
The IUPAC name of 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane (CID 142067637) is 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane.
What is the SMILES notation for 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane?
The canonical SMILES for 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane is C=CC1=C(C=C)C(=O)N(C(C)Cc2ccccc2)C1=O.CC.
What is the InChIKey of 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane?
The InChIKey is HHPYHKOVLQCXES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2.C2H6/c1-4-14-15(5-2)17(20)18(16(14)19)12(3)11-13-9-7-6-8-10-13;1-2/h4-10,12H,1-2,11H2,3H3;1-2H3.
What are the key properties of 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane?
3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane has a molecular weight of 297.40 g/mol, XLogP of 3.68, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis(ethenyl)-1-(1-phenylpropan-2-yl)pyrrole-2,5-dione;ethane is sourced from PubChem (CID 142067637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).