N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide

C15H22N2O5S — CID 3544806

IUPACN-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide
SMILESO=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCCO
InChIInChI=1S/C15H22N2O5S/c18-11-8-16-15(19)12-22-13-4-6-14(7-5-13)23(20,21)17-9-2-1-3-10-17/h4-7,18H,1-3,8-12H2,(H,16,19)
InChIKeyVNGFKOGZCYKHQY-UHFFFAOYSA-N
MW342.42 g/mol
LogP0.35
Rot. Bonds7

About N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide

N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide (PubChem CID 3544806) has the molecular formula C15H22N2O5S and a molecular weight of 342.42 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide
PubChem CID3544806
Molecular FormulaC15H22N2O5S
Molecular Weight342.42 g/mol
Exact Mass342.12
IUPAC NameN-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide
SMILESO=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCCO
InChIInChI=1S/C15H22N2O5S/c18-11-8-16-15(19)12-22-13-4-6-14(7-5-13)23(20,21)17-9-2-1-3-10-17/h4-7,18H,1-3,8-12H2,(H,16,19)
InChIKeyVNGFKOGZCYKHQY-UHFFFAOYSA-N
XLogP0.35
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxyethyl)-2-(4-morpholin-4-ylsulfonylphenoxy)acetamide
CID 6491401
2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]acetamide
CID 43875081
2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(2,2-dimethylpropyl)acetamide
CID 100800978
2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-[(4-fluorophenyl)methyl]acetamide
CID 28554565
methyl 2-(4-piperidin-1-ylsulfonylphenoxy)acetate
CID 1082948
N-butan-2-yl-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide
CID 4695524
N-(2,6-dichlorophenyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide
CID 3987191
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
CID 28562368
2-(4-morpholin-4-ylsulfonylphenoxy)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]acetamide
CID 28562499
2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-[[4-(dimethylsulfamoyl)phenyl]methyl]acetamide
CID 28562564
2-(4-morpholin-4-ylsulfonylphenoxy)-N-propylacetamide
CID 6491400
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenoxy)acetamide
CID 1010577

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide (CID 3544806) is N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide is O=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide?
The InChIKey is VNGFKOGZCYKHQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O5S/c18-11-8-16-15(19)12-22-13-4-6-14(7-5-13)23(20,21)17-9-2-1-3-10-17/h4-7,18H,1-3,8-12H2,(H,16,19).
What are the key properties of N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide?
N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide has a molecular weight of 342.42 g/mol, XLogP of 0.35, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(4-piperidin-1-ylsulfonylphenoxy)acetamide is sourced from PubChem (CID 3544806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).