N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide

C23H22N2O3 — CID 16822122

IUPACN-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide
SMILESCc1ccc(N2CC(NC(=O)COc3ccc4ccccc4c3)CC2=O)cc1
InChIInChI=1S/C23H22N2O3/c1-16-6-9-20(10-7-16)25-14-19(13-23(25)27)24-22(26)15-28-21-11-8-17-4-2-3-5-18(17)12-21/h2-12,19H,13-15H2,1H3,(H,24,26)
InChIKeyTVUHSVIVPSUAJF-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.45
Rot. Bonds5

About N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide

N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide (PubChem CID 16822122) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide
PubChem CID16822122
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC NameN-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide
SMILESCc1ccc(N2CC(NC(=O)COc3ccc4ccccc4c3)CC2=O)cc1
InChIInChI=1S/C23H22N2O3/c1-16-6-9-20(10-7-16)25-14-19(13-23(25)27)24-22(26)15-28-21-11-8-17-4-2-3-5-18(17)12-21/h2-12,19H,13-15H2,1H3,(H,24,26)
InChIKeyTVUHSVIVPSUAJF-UHFFFAOYSA-N
XLogP3.45
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxyphenoxy)-N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 16822124
N-[(3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-2-(4-methylphenoxy)acetamide
CID 7547885
N-[(3R)-1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-2-(4-methylphenoxy)acetamide
CID 7547881
2-(4-methoxyphenoxy)-N-(5-oxo-1-phenylpyrrolidin-3-yl)acetamide
CID 16822099
2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7546892
N-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-2-(4-methoxyphenoxy)acetamide
CID 16822158
N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide
CID 7563674
N-[(3S)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-(4-propan-2-ylphenoxy)acetamide
CID 7563716
2-(4-chlorophenoxy)-N-[(3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7547833
3-(4-methoxyphenyl)-N-[(3R)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]propanamide
CID 7255066
2-naphthalen-2-yloxy-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]acetamide
CID 16918271
N-[1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-2-phenylacetamide
CID 43971002

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide (CID 16822122) is N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide is Cc1ccc(N2CC(NC(=O)COc3ccc4ccccc4c3)CC2=O)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is TVUHSVIVPSUAJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-16-6-9-20(10-7-16)25-14-19(13-23(25)27)24-22(26)15-28-21-11-8-17-4-2-3-5-18(17)12-21/h2-12,19H,13-15H2,1H3,(H,24,26).
What are the key properties of N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide?
N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 374.44 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 16822122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).