N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide

C10H16N2O3S — CID 43629183

IUPACN-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCC(C)C(C)NS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C10H16N2O3S/c1-7(2)8(3)12-16(14,15)9-4-5-10(13)11-6-9/h4-8,12H,1-3H3,(H,11,13)
InChIKeyYKDLPLRPKIHMNI-UHFFFAOYSA-N
MW244.32 g/mol
LogP0.70
Rot. Bonds4

About N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide

N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 43629183) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID43629183
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC NameN-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCC(C)C(C)NS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C10H16N2O3S/c1-7(2)8(3)12-16(14,15)9-4-5-10(13)11-6-9/h4-8,12H,1-3H3,(H,11,13)
InChIKeyYKDLPLRPKIHMNI-UHFFFAOYSA-N
XLogP0.70
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylpentan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 54955517
N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61479202
N-(1-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629090
N-(3-methyl-2-propan-2-ylbutyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 102907510
N-(2-methylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629041
N-(4-methoxybutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64605936
2-[(6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-propylpropanamide
CID 61250492
6-oxo-N-(4-phenylbutan-2-yl)-1H-pyridine-3-sulfonamide
CID 43629384
N-methoxy-6-oxo-1H-pyridine-3-sulfonamide
CID 107858243
N-[1-(2,4-difluorophenyl)ethyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61249942
N-[1-(4-methylphenyl)propyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61247679
4-(3-methylbutan-2-ylsulfamoyl)benzenesulfonyl chloride
CID 43131428

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide (CID 43629183) is N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide is CC(C)C(C)NS(=O)(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is YKDLPLRPKIHMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-7(2)8(3)12-16(14,15)9-4-5-10(13)11-6-9/h4-8,12H,1-3H3,(H,11,13).
What are the key properties of N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 244.32 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 43629183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).