2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide

C15H22N2O4S — CID 35728244

IUPAC2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCCOCC(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C15H22N2O4S/c1-2-21-12-15(18)16-13-7-6-8-14(11-13)22(19,20)17-9-4-3-5-10-17/h6-8,11H,2-5,9-10,12H2,1H3,(H,16,18)
InChIKeyRPSQLKQGVXMKCQ-UHFFFAOYSA-N
MW326.42 g/mol
LogP1.84
Rot. Bonds6

About 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide

2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide (PubChem CID 35728244) has the molecular formula C15H22N2O4S and a molecular weight of 326.42 g/mol. Its IUPAC name is 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
PubChem CID35728244
Molecular FormulaC15H22N2O4S
Molecular Weight326.42 g/mol
Exact Mass326.13
IUPAC Name2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCCOCC(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C15H22N2O4S/c1-2-21-12-15(18)16-13-7-6-8-14(11-13)22(19,20)17-9-4-3-5-10-17/h6-8,11H,2-5,9-10,12H2,1H3,(H,16,18)
InChIKeyRPSQLKQGVXMKCQ-UHFFFAOYSA-N
XLogP1.84
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-piperidin-1-ylsulfonylphenyl)pentanamide
CID 8883555
2-bromo-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
CID 60651214
ethyl N-[3-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethoxy]phenyl]carbamate
CID 30582105
2-(3-methylphenoxy)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 9415053
N-[3-(azepan-1-ylsulfonyl)phenyl]-2-phenylacetamide
CID 4785250
N-(3-piperidin-1-ylsulfonylphenyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 7926190
2-piperidin-1-ium-1-yl-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 8894737
2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
CID 8692183
ethyl-[2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl]-[2-oxo-2-(propan-2-ylamino)ethyl]azanium
CID 8907098
[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-cyclohexylacetate
CID 35776383
2-(cyclopropylmethylamino)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide;hydrochloride
CID 119672230
2-(4-ethylpyridin-1-ium-1-yl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
CID 8857790

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide (CID 35728244) is 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide is CCOCC(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1.
What is the InChIKey of 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
The InChIKey is RPSQLKQGVXMKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4S/c1-2-21-12-15(18)16-13-7-6-8-14(11-13)22(19,20)17-9-4-3-5-10-17/h6-8,11H,2-5,9-10,12H2,1H3,(H,16,18).
What are the key properties of 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide has a molecular weight of 326.42 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(3-piperidin-1-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 35728244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).