3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide

C17H24N2O3 — CID 22387163

IUPAC3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide
SMILESCCCC1CC(=O)N(C(Cc2ccc(OC)cc2)C(N)=O)C1
InChIInChI=1S/C17H24N2O3/c1-3-4-13-10-16(20)19(11-13)15(17(18)21)9-12-5-7-14(22-2)8-6-12/h5-8,13,15H,3-4,9-11H2,1-2H3,(H2,18,21)
InChIKeyJVXYQONDPFKFIJ-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.74
Rot. Bonds7

About 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide

3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide (PubChem CID 22387163) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide
PubChem CID22387163
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide
SMILESCCCC1CC(=O)N(C(Cc2ccc(OC)cc2)C(N)=O)C1
InChIInChI=1S/C17H24N2O3/c1-3-4-13-10-16(20)19(11-13)15(17(18)21)9-12-5-7-14(22-2)8-6-12/h5-8,13,15H,3-4,9-11H2,1-2H3,(H2,18,21)
InChIKeyJVXYQONDPFKFIJ-UHFFFAOYSA-N
XLogP1.74
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide?
The IUPAC name of 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide (CID 22387163) is 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide is CCCC1CC(=O)N(C(Cc2ccc(OC)cc2)C(N)=O)C1.
What is the InChIKey of 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide?
The InChIKey is JVXYQONDPFKFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-3-4-13-10-16(20)19(11-13)15(17(18)21)9-12-5-7-14(22-2)8-6-12/h5-8,13,15H,3-4,9-11H2,1-2H3,(H2,18,21).
What are the key properties of 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide?
3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide has a molecular weight of 304.39 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-2-(2-oxo-4-propylpyrrolidin-1-yl)propanamide is sourced from PubChem (CID 22387163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).