N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide

C21H24N2O3 — CID 110373767

IUPACN-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide
SMILESCOc1cccc(CCNC(=O)C2CCC(=O)N2c2ccc(C)cc2)c1
InChIInChI=1S/C21H24N2O3/c1-15-6-8-17(9-7-15)23-19(10-11-20(23)24)21(25)22-13-12-16-4-3-5-18(14-16)26-2/h3-9,14,19H,10-13H2,1-2H3,(H,22,25)
InChIKeyMVQCDKJVARIUAL-UHFFFAOYSA-N
MW352.43 g/mol
LogP2.86
Rot. Bonds6

About N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide

N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 110373767) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID110373767
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC NameN-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide
SMILESCOc1cccc(CCNC(=O)C2CCC(=O)N2c2ccc(C)cc2)c1
InChIInChI=1S/C21H24N2O3/c1-15-6-8-17(9-7-15)23-19(10-11-20(23)24)21(25)22-13-12-16-4-3-5-18(14-16)26-2/h3-9,14,19H,10-13H2,1-2H3,(H,22,25)
InChIKeyMVQCDKJVARIUAL-UHFFFAOYSA-N
XLogP2.86
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[2-(3-methoxyphenyl)ethyl]-1-N-(4-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109137909
N-[2-(3-methoxyphenyl)ethyl]-1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113185970
1-(3,4-dimethylphenyl)-N-[2-(3-methoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 113186129
4-methoxy-N-[2-(3-methoxyphenyl)ethyl]cyclohexane-1-carboxamide
CID 112529647
N-[2-(3-methoxyphenyl)ethyl]cyclohexanecarboxamide
CID 47041879
N-(3-methoxyphenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110421968
1-(4-chlorophenyl)-N-[2-(4-methoxyphenoxy)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 110374043
N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110606566
2-N-[2-(3-methoxyphenyl)ethyl]-1-N-(3-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109137908
2-N-butyl-1-N-[2-(3-methoxyphenyl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109131252
2-[2-(3-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide
CID 108997173
2,2-dichloro-N-[2-(3-methoxyphenyl)ethyl]cyclopropane-1-carboxamide
CID 78879212

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide (CID 110373767) is N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide is COc1cccc(CCNC(=O)C2CCC(=O)N2c2ccc(C)cc2)c1.
What is the InChIKey of N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is MVQCDKJVARIUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-15-6-8-17(9-7-15)23-19(10-11-20(23)24)21(25)22-13-12-16-4-3-5-18(14-16)26-2/h3-9,14,19H,10-13H2,1-2H3,(H,22,25).
What are the key properties of N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide?
N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 352.43 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenyl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 110373767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).