2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide

C15H23N3O4S — CID 122566592

IUPAC2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NS(=O)(=O)CCOc2ccccc2)CC1
InChIInChI=1S/C15H23N3O4S/c16-15(19)12-18-8-6-13(7-9-18)17-23(20,21)11-10-22-14-4-2-1-3-5-14/h1-5,13,17H,6-12H2,(H2,16,19)
InChIKeyVJKBEBQLGZQJTH-UHFFFAOYSA-N
MW341.43 g/mol
LogP-0.07
Rot. Bonds8

About 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide

2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide (PubChem CID 122566592) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide
PubChem CID122566592
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC Name2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NS(=O)(=O)CCOc2ccccc2)CC1
InChIInChI=1S/C15H23N3O4S/c16-15(19)12-18-8-6-13(7-9-18)17-23(20,21)11-10-22-14-4-2-1-3-5-14/h1-5,13,17H,6-12H2,(H2,16,19)
InChIKeyVJKBEBQLGZQJTH-UHFFFAOYSA-N
XLogP-0.07
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide (CID 122566592) is 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide is NC(=O)CN1CCC(NS(=O)(=O)CCOc2ccccc2)CC1.
What is the InChIKey of 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide?
The InChIKey is VJKBEBQLGZQJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S/c16-15(19)12-18-8-6-13(7-9-18)17-23(20,21)11-10-22-14-4-2-1-3-5-14/h1-5,13,17H,6-12H2,(H2,16,19).
What are the key properties of 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide?
2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide has a molecular weight of 341.43 g/mol, XLogP of -0.07, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-phenoxyethylsulfonylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 122566592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).