1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide

C10H20N2O3S — CID 176667681

IUPAC1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide
SMILESNS(=O)(=O)C1CCN(CC2CCCO2)CC1
InChIInChI=1S/C10H20N2O3S/c11-16(13,14)10-3-5-12(6-4-10)8-9-2-1-7-15-9/h9-10H,1-8H2,(H2,11,13,14)
InChIKeyHQSBVBBJHUJDDL-UHFFFAOYSA-N
MW248.35 g/mol
LogP-0.08
Rot. Bonds3

About 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide

1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide (PubChem CID 176667681) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide.

Molecular Properties

Compound Name1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide
PubChem CID176667681
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC Name1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide
SMILESNS(=O)(=O)C1CCN(CC2CCCO2)CC1
InChIInChI=1S/C10H20N2O3S/c11-16(13,14)10-3-5-12(6-4-10)8-9-2-1-7-15-9/h9-10H,1-8H2,(H2,11,13,14)
InChIKeyHQSBVBBJHUJDDL-UHFFFAOYSA-N
XLogP-0.08
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide?
The IUPAC name of 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide (CID 176667681) is 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide.
What is the SMILES notation for 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide?
The canonical SMILES for 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide is NS(=O)(=O)C1CCN(CC2CCCO2)CC1.
What is the InChIKey of 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide?
The InChIKey is HQSBVBBJHUJDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S/c11-16(13,14)10-3-5-12(6-4-10)8-9-2-1-7-15-9/h9-10H,1-8H2,(H2,11,13,14).
What are the key properties of 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide?
1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide has a molecular weight of 248.35 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-ylmethyl)piperidine-4-sulfonamide is sourced from PubChem (CID 176667681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).