N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide

C17H19N3O5S — CID 10177607

IUPACN-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide
SMILESO=C(NO)c1ccccc1S(=O)(=O)N1CCC(Oc2ccncc2)CC1
InChIInChI=1S/C17H19N3O5S/c21-17(19-22)15-3-1-2-4-16(15)26(23,24)20-11-7-14(8-12-20)25-13-5-9-18-10-6-13/h1-6,9-10,14,22H,7-8,11-12H2,(H,19,21)
InChIKeyPNSDQBFKKMUHCP-UHFFFAOYSA-N
MW377.42 g/mol
LogP1.43
Rot. Bonds5

About N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide

N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide (PubChem CID 10177607) has the molecular formula C17H19N3O5S and a molecular weight of 377.42 g/mol. Its IUPAC name is N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide.

Molecular Properties

Compound NameN-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide
PubChem CID10177607
Molecular FormulaC17H19N3O5S
Molecular Weight377.42 g/mol
Exact Mass377.10
IUPAC NameN-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide
SMILESO=C(NO)c1ccccc1S(=O)(=O)N1CCC(Oc2ccncc2)CC1
InChIInChI=1S/C17H19N3O5S/c21-17(19-22)15-3-1-2-4-16(15)26(23,24)20-11-7-14(8-12-20)25-13-5-9-18-10-6-13/h1-6,9-10,14,22H,7-8,11-12H2,(H,19,21)
InChIKeyPNSDQBFKKMUHCP-UHFFFAOYSA-N
XLogP1.43
TPSA108.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide?
The IUPAC name of N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide (CID 10177607) is N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide.
What is the SMILES notation for N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide?
The canonical SMILES for N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide is O=C(NO)c1ccccc1S(=O)(=O)N1CCC(Oc2ccncc2)CC1.
What is the InChIKey of N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide?
The InChIKey is PNSDQBFKKMUHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O5S/c21-17(19-22)15-3-1-2-4-16(15)26(23,24)20-11-7-14(8-12-20)25-13-5-9-18-10-6-13/h1-6,9-10,14,22H,7-8,11-12H2,(H,19,21).
What are the key properties of N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide?
N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide has a molecular weight of 377.42 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(4-pyridin-4-yloxypiperidin-1-yl)sulfonylbenzamide is sourced from PubChem (CID 10177607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).