N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide

C8H16N2O2S — CID 59337380

IUPACN,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide
SMILESCNS(=O)(=O)N1CCC(C)=C(C)C1
InChIInChI=1S/C8H16N2O2S/c1-7-4-5-10(6-8(7)2)13(11,12)9-3/h9H,4-6H2,1-3H3
InChIKeyUHTSWEBQYPVBRS-UHFFFAOYSA-N
MW204.29 g/mol
LogP0.49
Rot. Bonds2

About N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide

N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide (PubChem CID 59337380) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide.

Molecular Properties

Compound NameN,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide
PubChem CID59337380
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC NameN,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide
SMILESCNS(=O)(=O)N1CCC(C)=C(C)C1
InChIInChI=1S/C8H16N2O2S/c1-7-4-5-10(6-8(7)2)13(11,12)9-3/h9H,4-6H2,1-3H3
InChIKeyUHTSWEBQYPVBRS-UHFFFAOYSA-N
XLogP0.49
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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1-(4,5-dimethyl-3,6-dihydro-2H-pyridin-1-yl)ethanone;ethane
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3-(4,5-dimethyl-3,6-dihydro-2H-pyridin-1-yl)cyclopent-2-en-1-one
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[1-(methylsulfamoyl)piperidin-4-yl]methylcarbamic acid
CID 130277576
6,8,9-tritert-butyl-N-methyl-1,3,4,8-tetrahydropyrazino[1,2-c]pyrimidine-2-sulfonamide
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3-ethyl-N,3-dimethylazetidine-1-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide?
The IUPAC name of N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide (CID 59337380) is N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide.
What is the SMILES notation for N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide?
The canonical SMILES for N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide is CNS(=O)(=O)N1CCC(C)=C(C)C1.
What is the InChIKey of N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide?
The InChIKey is UHTSWEBQYPVBRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-7-4-5-10(6-8(7)2)13(11,12)9-3/h9H,4-6H2,1-3H3.
What are the key properties of N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide?
N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide has a molecular weight of 204.29 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,5-trimethyl-3,6-dihydro-2H-pyridine-1-sulfonamide is sourced from PubChem (CID 59337380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).