4-methyl-1-(oxolan-3-ylsulfonyl)piperidine

C10H19NO3S — CID 127320297

IUPAC4-methyl-1-(oxolan-3-ylsulfonyl)piperidine
SMILESCC1CCN(S(=O)(=O)C2CCOC2)CC1
InChIInChI=1S/C10H19NO3S/c1-9-2-5-11(6-3-9)15(12,13)10-4-7-14-8-10/h9-10H,2-8H2,1H3
InChIKeyQFCSSHDHRNABNI-UHFFFAOYSA-N
MW233.33 g/mol
LogP0.84
Rot. Bonds2

About 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine

4-methyl-1-(oxolan-3-ylsulfonyl)piperidine (PubChem CID 127320297) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine.

Molecular Properties

Compound Name4-methyl-1-(oxolan-3-ylsulfonyl)piperidine
PubChem CID127320297
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC Name4-methyl-1-(oxolan-3-ylsulfonyl)piperidine
SMILESCC1CCN(S(=O)(=O)C2CCOC2)CC1
InChIInChI=1S/C10H19NO3S/c1-9-2-5-11(6-3-9)15(12,13)10-4-7-14-8-10/h9-10H,2-8H2,1H3
InChIKeyQFCSSHDHRNABNI-UHFFFAOYSA-N
XLogP0.84
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine?
The IUPAC name of 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine (CID 127320297) is 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine.
What is the SMILES notation for 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine?
The canonical SMILES for 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine is CC1CCN(S(=O)(=O)C2CCOC2)CC1.
What is the InChIKey of 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine?
The InChIKey is QFCSSHDHRNABNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3S/c1-9-2-5-11(6-3-9)15(12,13)10-4-7-14-8-10/h9-10H,2-8H2,1H3.
What are the key properties of 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine?
4-methyl-1-(oxolan-3-ylsulfonyl)piperidine has a molecular weight of 233.33 g/mol, XLogP of 0.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(oxolan-3-ylsulfonyl)piperidine is sourced from PubChem (CID 127320297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).