N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide

C20H28N2O3 — CID 18106196

IUPACN-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
SMILESO=C(COc1cccc(N2CCCC2=O)c1)NC1CCCCCCC1
InChIInChI=1S/C20H28N2O3/c23-19(21-16-8-4-2-1-3-5-9-16)15-25-18-11-6-10-17(14-18)22-13-7-12-20(22)24/h6,10-11,14,16H,1-5,7-9,12-13,15H2,(H,21,23)
InChIKeyAJYXDUANYFKECA-UHFFFAOYSA-N
MW344.45 g/mol
LogP3.42
Rot. Bonds5

About N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide

N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide (PubChem CID 18106196) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
PubChem CID18106196
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC NameN-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
SMILESO=C(COc1cccc(N2CCCC2=O)c1)NC1CCCCCCC1
InChIInChI=1S/C20H28N2O3/c23-19(21-16-8-4-2-1-3-5-9-16)15-25-18-11-6-10-17(14-18)22-13-7-12-20(22)24/h6,10-11,14,16H,1-5,7-9,12-13,15H2,(H,21,23)
InChIKeyAJYXDUANYFKECA-UHFFFAOYSA-N
XLogP3.42
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(2-oxopyrrolidin-1-yl)phenoxy]-N-(1-phenylpiperidin-4-yl)acetamide
CID 86828694
N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 78901883
N-[2-(aminomethyl)cyclopentyl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide;hydrochloride
CID 119602651
N-(2-hydroxyethyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 78823345
1-[3-[2-[4-(methylamino)piperidin-1-yl]-2-oxoethoxy]phenyl]pyrrolidin-2-one
CID 119561650
N-cyclooctyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 4229482
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 29412100
N-(3-aminobutyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 119496961
N-(2,2-dimethyl-1-phenylpropyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 78864739
N-[(3-methylphenyl)methyl]-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 38294113
2-[3-(2-oxopyrrolidin-1-yl)phenoxy]-N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)acetamide
CID 47014571
N-cycloheptyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 26215976

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide?
The IUPAC name of N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide (CID 18106196) is N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide.
What is the SMILES notation for N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide?
The canonical SMILES for N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide is O=C(COc1cccc(N2CCCC2=O)c1)NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide?
The InChIKey is AJYXDUANYFKECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c23-19(21-16-8-4-2-1-3-5-9-16)15-25-18-11-6-10-17(14-18)22-13-7-12-20(22)24/h6,10-11,14,16H,1-5,7-9,12-13,15H2,(H,21,23).
What are the key properties of N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide?
N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide has a molecular weight of 344.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide is sourced from PubChem (CID 18106196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).