3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide

C15H18N2O4 — CID 100772393

IUPAC3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide
SMILESCOc1ccc(N(C)C(=O)CCN2C(=O)CCC2=O)cc1
InChIInChI=1S/C15H18N2O4/c1-16(11-3-5-12(21-2)6-4-11)13(18)9-10-17-14(19)7-8-15(17)20/h3-6H,7-10H2,1-2H3
InChIKeyUDOKNBAKHMYLES-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.20
Rot. Bonds5

About 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide

3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide (PubChem CID 100772393) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide.

Molecular Properties

Compound Name3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide
PubChem CID100772393
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide
SMILESCOc1ccc(N(C)C(=O)CCN2C(=O)CCC2=O)cc1
InChIInChI=1S/C15H18N2O4/c1-16(11-3-5-12(21-2)6-4-11)13(18)9-10-17-14(19)7-8-15(17)20/h3-6H,7-10H2,1-2H3
InChIKeyUDOKNBAKHMYLES-UHFFFAOYSA-N
XLogP1.20
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
CID 2736758
1-(((4-Methoxyphenyl)amino)methyl)pyrrolidine-2,5-dione
CID 748195
1-(4-(4-(2-Methoxyphenyl)-1-piperazinyl)butyl)-2,5-pyrrolidinedione
CID 3994476
1-(4-(4-Methoxyphenyl)piperazin-1-yl)ethanone
CID 831828
1-(4-Methoxyphenyl)-2,5-pyrrolidinedione
CID 345843
1-(4-Methoxyphenyl)-1H-pyrrole-2,5-dione
CID 236788
2,5-Pyrrolidinedione, 1-(4-methoxyphenyl)-3-(1-piperidinyl)-
CID 2732613
Succinimide, 3-chloro-N-(p-methoxyphenyl)-
CID 99724
Pyrrolidine, 1-(4-methoxyphenyl)-
CID 143187
N-(4-methoxyphenyl)-2-oxo-1-propylpyridine-3-carboxamide
CID 1486129
1-Ethyl-3-[4-(3-methoxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione
CID 2950914
1-(4-ethoxyphenyl)-5-oxo-N-propylpyrrolidine-3-carboxamide
CID 3153845

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide?
The IUPAC name of 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide (CID 100772393) is 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide.
What is the SMILES notation for 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide?
The canonical SMILES for 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide is COc1ccc(N(C)C(=O)CCN2C(=O)CCC2=O)cc1.
What is the InChIKey of 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide?
The InChIKey is UDOKNBAKHMYLES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-16(11-3-5-12(21-2)6-4-11)13(18)9-10-17-14(19)7-8-15(17)20/h3-6H,7-10H2,1-2H3.
What are the key properties of 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide?
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide has a molecular weight of 290.32 g/mol, XLogP of 1.20, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methoxyphenyl)-N-methylpropanamide is sourced from PubChem (CID 100772393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).