N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide

C16H22N2O4S — CID 110666979

IUPACN-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide
SMILESO=C1CCCCN1c1ccc(S(=O)(=O)NOC2CCCC2)cc1
InChIInChI=1S/C16H22N2O4S/c19-16-7-3-4-12-18(16)13-8-10-15(11-9-13)23(20,21)17-22-14-5-1-2-6-14/h8-11,14,17H,1-7,12H2
InChIKeyJVEPIAXLQXLBIP-UHFFFAOYSA-N
MW338.43 g/mol
LogP2.36
Rot. Bonds5

About N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide

N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide (PubChem CID 110666979) has the molecular formula C16H22N2O4S and a molecular weight of 338.43 g/mol. Its IUPAC name is N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide
PubChem CID110666979
Molecular FormulaC16H22N2O4S
Molecular Weight338.43 g/mol
Exact Mass338.13
IUPAC NameN-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide
SMILESO=C1CCCCN1c1ccc(S(=O)(=O)NOC2CCCC2)cc1
InChIInChI=1S/C16H22N2O4S/c19-16-7-3-4-12-18(16)13-8-10-15(11-9-13)23(20,21)17-22-14-5-1-2-6-14/h8-11,14,17H,1-7,12H2
InChIKeyJVEPIAXLQXLBIP-UHFFFAOYSA-N
XLogP2.36
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyloxy-4-(2,6-dioxopiperidin-1-yl)benzenesulfonamide
CID 110666980
N-cyclooctyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 18096700
N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 22695508
N-[(1R,6R)-7-bicyclo[4.1.0]heptanyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 98137665
4-(2-oxopyrrolidin-1-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 8823939
N-[(2R)-butan-2-yl]-4-(2-oxopiperidin-1-yl)benzenesulfonamide
CID 42346693
N-(dicyclopropylmethyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 31847318
N-[4-(2-oxopiperidin-1-yl)phenyl]benzenesulfonamide
CID 7636091
N-(2-cyclohexylsulfanylethyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 92685610
N-(2-cyanopropan-2-yl)-4-(2-oxopiperidin-1-yl)benzenesulfonamide
CID 110615020
N-cyclopentyloxy-4-propan-2-ylbenzenesulfonamide
CID 83228861
4-(2-oxopiperidin-1-yl)-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide
CID 110312144

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide?
The IUPAC name of N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide (CID 110666979) is N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide is O=C1CCCCN1c1ccc(S(=O)(=O)NOC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide?
The InChIKey is JVEPIAXLQXLBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O4S/c19-16-7-3-4-12-18(16)13-8-10-15(11-9-13)23(20,21)17-22-14-5-1-2-6-14/h8-11,14,17H,1-7,12H2.
What are the key properties of N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide?
N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide has a molecular weight of 338.43 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 110666979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).