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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Related Compounds

2-[(2R)-1-phenylpropan-2-yl]isoindole-1,3-dione
CID 1121128
2-[1-(4-phenylphenyl)propan-2-yl]isoindole-1,3-dione
CID 14368628
(2S,3S)-3-methyl-1-phenylpent-4-en-2-ol
CID 101389726
ethane;2-methylpropylbenzene
CID 162200929
4-methyl-1-[(2R)-1-phenylpropan-2-yl]-4-propylpiperidine-2,6-dione
CID 125485057
[(2R)-2-methylpent-4-enyl]benzene
CID 163762006
hydroxy-oxo-(1-phenylpropan-2-yl)phosphanium
CID 67592764
4-(1-phenylpropan-2-yl)piperazine-2,6-dione
CID 63788386
4-methyl-5-phenylpent-1-en-3-one
CID 21353103
1-(1-phenylpropan-2-yl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione
CID 13220410
(2S,3S)-2-benzyl-3-methylpent-4-enoic acid
CID 101105346
(2S,3S)-3-methyl-4-phenylbutan-2-ol
CID 11194521

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).