N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C22H26N2O3 — CID 9469985

IUPACN-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOc1ccc(C)cc1CN(C)C(=O)Cc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C22H26N2O3/c1-16-6-11-20(27-3)18(13-16)15-23(2)22(26)14-17-7-9-19(10-8-17)24-12-4-5-21(24)25/h6-11,13H,4-5,12,14-15H2,1-3H3
InChIKeyXTSIKNJCZHNGEF-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.33
Rot. Bonds6

About N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 9469985) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID9469985
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOc1ccc(C)cc1CN(C)C(=O)Cc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C22H26N2O3/c1-16-6-11-20(27-3)18(13-16)15-23(2)22(26)14-17-7-9-19(10-8-17)24-12-4-5-21(24)25/h6-11,13H,4-5,12,14-15H2,1-3H3
InChIKeyXTSIKNJCZHNGEF-UHFFFAOYSA-N
XLogP3.33
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 8805849
N-benzyl-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27666071
N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27447938
N-[1-(2-methoxy-5-methylphenyl)ethyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 51220443
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 31847985
2-methoxy-5-[[[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzoic acid
CID 45384959
(2S)-2-methyl-3-[methyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]propanoic acid
CID 124689242
N-[(4-methoxyphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 51240858
N-[2-[(2,4-dimethylphenyl)methyl-methylamino]-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 9228101
2-(3,4-dimethoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686452
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9299632
N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 46486165

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 9469985) is N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide is COc1ccc(C)cc1CN(C)C(=O)Cc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is XTSIKNJCZHNGEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-16-6-11-20(27-3)18(13-16)15-23(2)22(26)14-17-7-9-19(10-8-17)24-12-4-5-21(24)25/h6-11,13H,4-5,12,14-15H2,1-3H3.
What are the key properties of N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 366.46 g/mol, XLogP of 3.33, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 9469985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).