3-cyclobutylsulfonylpiperidine

C9H17NO2S — CID 115070306

IUPAC3-cyclobutylsulfonylpiperidine
SMILESO=S(=O)(C1CCC1)C1CCCNC1
InChIInChI=1S/C9H17NO2S/c11-13(12,8-3-1-4-8)9-5-2-6-10-7-9/h8-10H,1-7H2
InChIKeyGJDPZXQEGZPORX-UHFFFAOYSA-N
MW203.31 g/mol
LogP0.71
Rot. Bonds2

About 3-cyclobutylsulfonylpiperidine

3-cyclobutylsulfonylpiperidine (PubChem CID 115070306) has the molecular formula C9H17NO2S and a molecular weight of 203.31 g/mol. Its IUPAC name is 3-cyclobutylsulfonylpiperidine.

Molecular Properties

Compound Name3-cyclobutylsulfonylpiperidine
PubChem CID115070306
Molecular FormulaC9H17NO2S
Molecular Weight203.31 g/mol
Exact Mass203.10
IUPAC Name3-cyclobutylsulfonylpiperidine
SMILESO=S(=O)(C1CCC1)C1CCCNC1
InChIInChI=1S/C9H17NO2S/c11-13(12,8-3-1-4-8)9-5-2-6-10-7-9/h8-10H,1-7H2
InChIKeyGJDPZXQEGZPORX-UHFFFAOYSA-N
XLogP0.71
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.31
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-methylsulfonylpiperidine;hydrochloride
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2-piperidin-3-ylsulfonylpyrimidine
CID 71645525
2-methylpropane;piperidine-3-sulfonamide
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3-prop-2-ynylsulfonylpiperidine
CID 84755128
2-piperidin-3-ylsulfonylacetamide
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N-(3-methylbutyl)piperidine-3-sulfonamide
CID 24702359
3-piperidin-3-ylsulfonylpropanoic acid
CID 84755096
3-(benzenesulfonyl)piperidine;ethane
CID 142376077
2,6-dimethyl-4-piperidin-3-ylsulfonylmorpholine
CID 24700642
N-(2-methoxycyclopentyl)piperidine-3-sulfonamide
CID 55033326

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutylsulfonylpiperidine?
The IUPAC name of 3-cyclobutylsulfonylpiperidine (CID 115070306) is 3-cyclobutylsulfonylpiperidine.
What is the SMILES notation for 3-cyclobutylsulfonylpiperidine?
The canonical SMILES for 3-cyclobutylsulfonylpiperidine is O=S(=O)(C1CCC1)C1CCCNC1.
What is the InChIKey of 3-cyclobutylsulfonylpiperidine?
The InChIKey is GJDPZXQEGZPORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2S/c11-13(12,8-3-1-4-8)9-5-2-6-10-7-9/h8-10H,1-7H2.
What are the key properties of 3-cyclobutylsulfonylpiperidine?
3-cyclobutylsulfonylpiperidine has a molecular weight of 203.31 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutylsulfonylpiperidine is sourced from PubChem (CID 115070306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).