2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide

C11H23N3O4S — CID 63246713

IUPAC2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide
SMILESCCOCCS(=O)(=O)N(CC(N)=O)C1CCNCC1
InChIInChI=1S/C11H23N3O4S/c1-2-18-7-8-19(16,17)14(9-11(12)15)10-3-5-13-6-4-10/h10,13H,2-9H2,1H3,(H2,12,15)
InChIKeyJCAMSJMMEXMUKV-UHFFFAOYSA-N
MW293.39 g/mol
LogP-1.11
Rot. Bonds8

About 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide

2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide (PubChem CID 63246713) has the molecular formula C11H23N3O4S and a molecular weight of 293.39 g/mol. Its IUPAC name is 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide.

Molecular Properties

Compound Name2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide
PubChem CID63246713
Molecular FormulaC11H23N3O4S
Molecular Weight293.39 g/mol
Exact Mass293.14
IUPAC Name2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide
SMILESCCOCCS(=O)(=O)N(CC(N)=O)C1CCNCC1
InChIInChI=1S/C11H23N3O4S/c1-2-18-7-8-19(16,17)14(9-11(12)15)10-3-5-13-6-4-10/h10,13H,2-9H2,1H3,(H2,12,15)
InChIKeyJCAMSJMMEXMUKV-UHFFFAOYSA-N
XLogP-1.11
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 5-1.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-ethoxy-N-ethyl-N-piperidin-4-ylethanesulfonamide
CID 63246667
2-ethoxy-N-piperidin-4-yl-N-propylethanesulfonamide;hydrochloride
CID 119993802
methyl 2-[(2-amino-2-oxoethyl)-piperidin-4-ylsulfamoyl]acetate
CID 61360325
2-[methylsulfamoyl(piperidin-4-yl)amino]acetamide
CID 114810545
N-(3-aminopropyl)-N-cyclopropyl-2-ethoxyethanesulfonamide
CID 63246125
N-cyclopropyl-2-ethoxy-N-(piperidin-3-ylmethyl)ethanesulfonamide
CID 106631255
2-[azepan-1-ylsulfonyl(piperidin-4-yl)amino]acetamide
CID 60801061
2-[2-methylpropylsulfamoyl(piperidin-4-yl)amino]acetamide
CID 114816010
N-(2-chloroethyl)-N-cyclopentyl-2-ethoxyethanesulfonamide
CID 63396597
2-ethoxy-N-methyl-N-(2-piperidin-4-ylethyl)ethanesulfonamide
CID 55173527
2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide
CID 107651092
2-ethoxy-N-(piperidin-4-ylmethyl)-N-propylethanesulfonamide
CID 79717397

Frequently Asked Questions

What is the IUPAC name of 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide?
The IUPAC name of 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide (CID 63246713) is 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide.
What is the SMILES notation for 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide?
The canonical SMILES for 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide is CCOCCS(=O)(=O)N(CC(N)=O)C1CCNCC1.
What is the InChIKey of 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide?
The InChIKey is JCAMSJMMEXMUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O4S/c1-2-18-7-8-19(16,17)14(9-11(12)15)10-3-5-13-6-4-10/h10,13H,2-9H2,1H3,(H2,12,15).
What are the key properties of 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide?
2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide has a molecular weight of 293.39 g/mol, XLogP of -1.11, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide is sourced from PubChem (CID 63246713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).