4-ethylpiperidine-1-sulfonamide

C7H16N2O2S — CID 45080629

IUPAC4-ethylpiperidine-1-sulfonamide
SMILESCCC1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C7H16N2O2S/c1-2-7-3-5-9(6-4-7)12(8,10)11/h7H,2-6H2,1H3,(H2,8,10,11)
InChIKeyGVMWAVASRJCEPN-UHFFFAOYSA-N
MW192.28 g/mol
LogP0.31
Rot. Bonds2

About 4-ethylpiperidine-1-sulfonamide

4-ethylpiperidine-1-sulfonamide (PubChem CID 45080629) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is 4-ethylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-ethylpiperidine-1-sulfonamide
PubChem CID45080629
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name4-ethylpiperidine-1-sulfonamide
SMILESCCC1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C7H16N2O2S/c1-2-7-3-5-9(6-4-7)12(8,10)11/h7H,2-6H2,1H3,(H2,8,10,11)
InChIKeyGVMWAVASRJCEPN-UHFFFAOYSA-N
XLogP0.31
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethylpiperidine-1-sulfonamide?
The IUPAC name of 4-ethylpiperidine-1-sulfonamide (CID 45080629) is 4-ethylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-ethylpiperidine-1-sulfonamide?
The canonical SMILES for 4-ethylpiperidine-1-sulfonamide is CCC1CCN(S(N)(=O)=O)CC1.
What is the InChIKey of 4-ethylpiperidine-1-sulfonamide?
The InChIKey is GVMWAVASRJCEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-2-7-3-5-9(6-4-7)12(8,10)11/h7H,2-6H2,1H3,(H2,8,10,11).
What are the key properties of 4-ethylpiperidine-1-sulfonamide?
4-ethylpiperidine-1-sulfonamide has a molecular weight of 192.28 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylpiperidine-1-sulfonamide is sourced from PubChem (CID 45080629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).