6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide

C10H16ClN3O4S2 — CID 63864494

IUPAC6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide
SMILESCC(C)(CNS(=O)(=O)c1ccc(Cl)nc1)NS(C)(=O)=O
InChIInChI=1S/C10H16ClN3O4S2/c1-10(2,14-19(3,15)16)7-13-20(17,18)8-4-5-9(11)12-6-8/h4-6,13-14H,7H2,1-3H3
InChIKeyPASYFYMJAQLZCQ-UHFFFAOYSA-N
MW341.84 g/mol
LogP0.34
Rot. Bonds6

About 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide

6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide (PubChem CID 63864494) has the molecular formula C10H16ClN3O4S2 and a molecular weight of 341.84 g/mol. Its IUPAC name is 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide
PubChem CID63864494
Molecular FormulaC10H16ClN3O4S2
Molecular Weight341.84 g/mol
Exact Mass341.03
IUPAC Name6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide
SMILESCC(C)(CNS(=O)(=O)c1ccc(Cl)nc1)NS(C)(=O)=O
InChIInChI=1S/C10H16ClN3O4S2/c1-10(2,14-19(3,15)16)7-13-20(17,18)8-4-5-9(11)12-6-8/h4-6,13-14H,7H2,1-3H3
InChIKeyPASYFYMJAQLZCQ-UHFFFAOYSA-N
XLogP0.34
TPSA105.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(methanesulfonamido)-2-methylpropyl]-6-(methylamino)pyridine-3-sulfonamide
CID 63862617
6-chloro-N-(2-hydroxypropan-2-yl)pyridine-3-sulfonamide
CID 90954115
6-chloro-N-(5-hydroxy-2,2-dimethylpentyl)pyridine-3-sulfonamide
CID 113347931
N-[2-(methanesulfonamido)-2-methylpropyl]-1H-pyrazole-4-sulfonamide
CID 63859195
6-chloro-N-[3-[(6-chloro-3-pyridinyl)sulfonylamino]propyl]pyridine-3-sulfonamide
CID 4729949
6-chloro-N-(2-ethylbutyl)pyridine-3-sulfonamide
CID 115613422
4-bromo-3-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
CID 103697603
6-chloro-N-(2-hydroxyethyl)pyridine-3-sulfonamide
CID 4862052
6-chloro-N-[(2R)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
CID 86668141
6-chloro-N-[(1-methylsulfanylcyclopropyl)methyl]pyridine-3-sulfonamide
CID 107271026
6-chloro-N-[(4-chlorophenyl)methyl]pyridine-3-sulfonamide
CID 826869
2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
CID 81245129

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide?
The IUPAC name of 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide (CID 63864494) is 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide is CC(C)(CNS(=O)(=O)c1ccc(Cl)nc1)NS(C)(=O)=O.
What is the InChIKey of 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide?
The InChIKey is PASYFYMJAQLZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3O4S2/c1-10(2,14-19(3,15)16)7-13-20(17,18)8-4-5-9(11)12-6-8/h4-6,13-14H,7H2,1-3H3.
What are the key properties of 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide?
6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide has a molecular weight of 341.84 g/mol, XLogP of 0.34, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-3-sulfonamide is sourced from PubChem (CID 63864494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).