1-cyclopropylsulfonyl-4-ethenylpiperidine

C10H17NO2S — CID 59235701

IUPAC1-cyclopropylsulfonyl-4-ethenylpiperidine
SMILESC=CC1CCN(S(=O)(=O)C2CC2)CC1
InChIInChI=1S/C10H17NO2S/c1-2-9-5-7-11(8-6-9)14(12,13)10-3-4-10/h2,9-10H,1,3-8H2
InChIKeyYMYRWUPDAVYMJD-UHFFFAOYSA-N
MW215.32 g/mol
LogP1.38
Rot. Bonds3

About 1-cyclopropylsulfonyl-4-ethenylpiperidine

1-cyclopropylsulfonyl-4-ethenylpiperidine (PubChem CID 59235701) has the molecular formula C10H17NO2S and a molecular weight of 215.32 g/mol. Its IUPAC name is 1-cyclopropylsulfonyl-4-ethenylpiperidine.

Molecular Properties

Compound Name1-cyclopropylsulfonyl-4-ethenylpiperidine
PubChem CID59235701
Molecular FormulaC10H17NO2S
Molecular Weight215.32 g/mol
Exact Mass215.10
IUPAC Name1-cyclopropylsulfonyl-4-ethenylpiperidine
SMILESC=CC1CCN(S(=O)(=O)C2CC2)CC1
InChIInChI=1S/C10H17NO2S/c1-2-9-5-7-11(8-6-9)14(12,13)10-3-4-10/h2,9-10H,1,3-8H2
InChIKeyYMYRWUPDAVYMJD-UHFFFAOYSA-N
XLogP1.38
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylsulfonyl-4-ethenylpiperidine?
The IUPAC name of 1-cyclopropylsulfonyl-4-ethenylpiperidine (CID 59235701) is 1-cyclopropylsulfonyl-4-ethenylpiperidine.
What is the SMILES notation for 1-cyclopropylsulfonyl-4-ethenylpiperidine?
The canonical SMILES for 1-cyclopropylsulfonyl-4-ethenylpiperidine is C=CC1CCN(S(=O)(=O)C2CC2)CC1.
What is the InChIKey of 1-cyclopropylsulfonyl-4-ethenylpiperidine?
The InChIKey is YMYRWUPDAVYMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2S/c1-2-9-5-7-11(8-6-9)14(12,13)10-3-4-10/h2,9-10H,1,3-8H2.
What are the key properties of 1-cyclopropylsulfonyl-4-ethenylpiperidine?
1-cyclopropylsulfonyl-4-ethenylpiperidine has a molecular weight of 215.32 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylsulfonyl-4-ethenylpiperidine is sourced from PubChem (CID 59235701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).