N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide

C10H20N2O3S — CID 51886370

IUPACN-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide
SMILESO=S(=O)(NC[C@@H]1CCCO1)N1CCCCC1
InChIInChI=1S/C10H20N2O3S/c13-16(14,12-6-2-1-3-7-12)11-9-10-5-4-8-15-10/h10-11H,1-9H2/t10-/m0/s1
InChIKeyUJPVNTQQEYZMBA-JTQLQIEISA-N
MW248.35 g/mol
LogP0.49
Rot. Bonds4

About N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide

N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide (PubChem CID 51886370) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide
PubChem CID51886370
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC NameN-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide
SMILESO=S(=O)(NC[C@@H]1CCCO1)N1CCCCC1
InChIInChI=1S/C10H20N2O3S/c13-16(14,12-6-2-1-3-7-12)11-9-10-5-4-8-15-10/h10-11H,1-9H2/t10-/m0/s1
InChIKeyUJPVNTQQEYZMBA-JTQLQIEISA-N
XLogP0.49
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide?
The IUPAC name of N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide (CID 51886370) is N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide.
What is the SMILES notation for N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide?
The canonical SMILES for N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide is O=S(=O)(NC[C@@H]1CCCO1)N1CCCCC1.
What is the InChIKey of N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide?
The InChIKey is UJPVNTQQEYZMBA-JTQLQIEISA-N. The full InChI is InChI=1S/C10H20N2O3S/c13-16(14,12-6-2-1-3-7-12)11-9-10-5-4-8-15-10/h10-11H,1-9H2/t10-/m0/s1.
What are the key properties of N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide?
N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide has a molecular weight of 248.35 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-oxolan-2-yl]methyl]piperidine-1-sulfonamide is sourced from PubChem (CID 51886370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).