N,4,4-trimethylpiperidine-1-sulfonamide

C8H18N2O2S — CID 67128610

IUPACN,4,4-trimethylpiperidine-1-sulfonamide
SMILESCNS(=O)(=O)N1CCC(C)(C)CC1
InChIInChI=1S/C8H18N2O2S/c1-8(2)4-6-10(7-5-8)13(11,12)9-3/h9H,4-7H2,1-3H3
InChIKeyHAVZNEJPDWSIGY-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.57
Rot. Bonds2

About N,4,4-trimethylpiperidine-1-sulfonamide

N,4,4-trimethylpiperidine-1-sulfonamide (PubChem CID 67128610) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N,4,4-trimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN,4,4-trimethylpiperidine-1-sulfonamide
PubChem CID67128610
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN,4,4-trimethylpiperidine-1-sulfonamide
SMILESCNS(=O)(=O)N1CCC(C)(C)CC1
InChIInChI=1S/C8H18N2O2S/c1-8(2)4-6-10(7-5-8)13(11,12)9-3/h9H,4-7H2,1-3H3
InChIKeyHAVZNEJPDWSIGY-UHFFFAOYSA-N
XLogP0.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,4,4-trimethylpiperidine-1-sulfonamide?
The IUPAC name of N,4,4-trimethylpiperidine-1-sulfonamide (CID 67128610) is N,4,4-trimethylpiperidine-1-sulfonamide.
What is the SMILES notation for N,4,4-trimethylpiperidine-1-sulfonamide?
The canonical SMILES for N,4,4-trimethylpiperidine-1-sulfonamide is CNS(=O)(=O)N1CCC(C)(C)CC1.
What is the InChIKey of N,4,4-trimethylpiperidine-1-sulfonamide?
The InChIKey is HAVZNEJPDWSIGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-8(2)4-6-10(7-5-8)13(11,12)9-3/h9H,4-7H2,1-3H3.
What are the key properties of N,4,4-trimethylpiperidine-1-sulfonamide?
N,4,4-trimethylpiperidine-1-sulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,4-trimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 67128610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).