5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide

C10H13ClN2O3S — CID 113485860

IUPAC5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCC1(NS(=O)(=O)c2c[nH]c(=O)c(Cl)c2)CCC1
InChIInChI=1S/C10H13ClN2O3S/c1-10(3-2-4-10)13-17(15,16)7-5-8(11)9(14)12-6-7/h5-6,13H,2-4H2,1H3,(H,12,14)
InChIKeyPTTSBHUIBDAZCK-UHFFFAOYSA-N
MW276.75 g/mol
LogP1.25
Rot. Bonds3

About 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide

5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 113485860) has the molecular formula C10H13ClN2O3S and a molecular weight of 276.75 g/mol. Its IUPAC name is 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID113485860
Molecular FormulaC10H13ClN2O3S
Molecular Weight276.75 g/mol
Exact Mass276.03
IUPAC Name5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCC1(NS(=O)(=O)c2c[nH]c(=O)c(Cl)c2)CCC1
InChIInChI=1S/C10H13ClN2O3S/c1-10(3-2-4-10)13-17(15,16)7-5-8(11)9(14)12-6-7/h5-6,13H,2-4H2,1H3,(H,12,14)
InChIKeyPTTSBHUIBDAZCK-UHFFFAOYSA-N
XLogP1.25
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.75
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(2,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64606342
5-chloro-N-(2,6-dibromo-4-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64608816
5-chloro-N-(3,4-dichlorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64607480
4-[(1-methylcyclobutyl)sulfamoyl]benzenesulfonyl chloride
CID 113485497
5-chloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 65123017
5-chloro-N-(2-ethylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64606531
5-chloro-N-(2,4-dimethylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64608237
5-chloro-N-(1-cyclopropylpropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64607914
2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]propanoic acid
CID 64608093
5-chloro-N,N-dimethyl-6-oxo-1H-pyridine-3-sulfonamide
CID 64608442
5-chloro-N-(4-iodo-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64607321
5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64607304

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide (CID 113485860) is 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide is CC1(NS(=O)(=O)c2c[nH]c(=O)c(Cl)c2)CCC1.
What is the InChIKey of 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is PTTSBHUIBDAZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O3S/c1-10(3-2-4-10)13-17(15,16)7-5-8(11)9(14)12-6-7/h5-6,13H,2-4H2,1H3,(H,12,14).
What are the key properties of 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide?
5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 276.75 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 113485860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).