3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide

C22H26N2O2 — CID 24601082

IUPAC3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1
InChIInChI=1S/C22H26N2O2/c1-3-17-6-8-18(9-7-17)10-13-21(25)23-19-11-12-20(16(2)15-19)24-14-4-5-22(24)26/h6-9,11-12,15H,3-5,10,13-14H2,1-2H3,(H,23,25)
InChIKeyAEBCAHBTQNFMJV-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.26
Rot. Bonds6

About 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide

3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide (PubChem CID 24601082) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
PubChem CID24601082
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1
InChIInChI=1S/C22H26N2O2/c1-3-17-6-8-18(9-7-17)10-13-21(25)23-19-11-12-20(16(2)15-19)24-14-4-5-22(24)26/h6-9,11-12,15H,3-5,10,13-14H2,1-2H3,(H,23,25)
InChIKeyAEBCAHBTQNFMJV-UHFFFAOYSA-N
XLogP4.26
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pentanamide
CID 43347098
4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 24601128
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-2-(propan-2-ylamino)acetamide
CID 60718577
2,2-dimethyl-N-[3-[3-methyl-4-(2-oxopyrrolidin-1-yl)anilino]-3-oxopropyl]propanamide
CID 18155158
2-(3-chlorophenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 100517923
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 7687070
[2-[3-methyl-4-(2-oxopiperidin-1-yl)anilino]-2-oxoethyl] 2,2-dimethylpropanoate
CID 7687437
[2-[3-methyl-4-(2-oxopyrrolidin-1-yl)anilino]-2-oxoethyl] 2,2-dimethylpropanoate
CID 7686604
N'-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-N-propyloxamide
CID 30679260
3-(1,4-dioxo-3H-phthalazin-2-yl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 24601100
[2-[3-methyl-4-(2-oxopiperidin-1-yl)anilino]-2-oxoethyl] 2-methylpropanoate
CID 7687436
N-[3-methyl-4-(2-oxopiperidin-1-yl)phenyl]cyclopropanecarboxamide
CID 7687364

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The IUPAC name of 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide (CID 24601082) is 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide.
What is the SMILES notation for 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The canonical SMILES for 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide is CCc1ccc(CCC(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1.
What is the InChIKey of 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The InChIKey is AEBCAHBTQNFMJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-3-17-6-8-18(9-7-17)10-13-21(25)23-19-11-12-20(16(2)15-19)24-14-4-5-22(24)26/h6-9,11-12,15H,3-5,10,13-14H2,1-2H3,(H,23,25).
What are the key properties of 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide has a molecular weight of 350.46 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide is sourced from PubChem (CID 24601082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).