2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide

C20H22N2O3 — CID 7687320

IUPAC2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc(N3CCCCC3=O)cc2)c1
InChIInChI=1S/C20H22N2O3/c1-15-5-4-6-18(13-15)25-14-19(23)21-16-8-10-17(11-9-16)22-12-3-2-7-20(22)24/h4-6,8-11,13H,2-3,7,12,14H2,1H3,(H,21,23)
InChIKeyUMZCTFSYKQUQIY-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.53
Rot. Bonds5

About 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide

2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide (PubChem CID 7687320) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide
PubChem CID7687320
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc(N3CCCCC3=O)cc2)c1
InChIInChI=1S/C20H22N2O3/c1-15-5-4-6-18(13-15)25-14-19(23)21-16-8-10-17(11-9-16)22-12-3-2-7-20(22)24/h4-6,8-11,13H,2-3,7,12,14H2,1H3,(H,21,23)
InChIKeyUMZCTFSYKQUQIY-UHFFFAOYSA-N
XLogP3.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenoxy)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 8716554
2-(4-methoxyphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 7687329
N-(3,5-dimethylphenyl)-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 26685964
2-(3-methylphenoxy)-N-[(Z)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]ethylideneamino]acetamide
CID 8979018
(2S)-2-(3-methylphenoxy)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 92681474
2-ethoxy-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 7687285
N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 30703287
2-(4-methoxyphenoxy)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 7687689
N-[(4-acetamidophenyl)methyl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 18154204
methyl 4-[[2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetyl]amino]benzoate
CID 26685968
2-[4-(2-oxopyrrolidin-1-yl)phenoxy]-N-(3-phenoxyphenyl)acetamide
CID 55411979
N-[(3-methylphenyl)methyl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 38294113

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide (CID 7687320) is 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide is Cc1cccc(OCC(=O)Nc2ccc(N3CCCCC3=O)cc2)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide?
The InChIKey is UMZCTFSYKQUQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-15-5-4-6-18(13-15)25-14-19(23)21-16-8-10-17(11-9-16)22-12-3-2-7-20(22)24/h4-6,8-11,13H,2-3,7,12,14H2,1H3,(H,21,23).
What are the key properties of 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide?
2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide has a molecular weight of 338.41 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-[4-(2-oxopiperidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 7687320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).