4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide

C10H17N3O5S2 — CID 126828311

IUPAC4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide
SMILESCCC(CS(=O)(=O)Nc1ccnc(S(N)(=O)=O)c1)OC
InChIInChI=1S/C10H17N3O5S2/c1-3-9(18-2)7-19(14,15)13-8-4-5-12-10(6-8)20(11,16)17/h4-6,9H,3,7H2,1-2H3,(H,12,13)(H2,11,16,17)
InChIKeyIUIOWZMGJMFNAO-UHFFFAOYSA-N
MW323.40 g/mol
LogP-0.10
Rot. Bonds7

About 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide

4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide (PubChem CID 126828311) has the molecular formula C10H17N3O5S2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound Name4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide
PubChem CID126828311
Molecular FormulaC10H17N3O5S2
Molecular Weight323.40 g/mol
Exact Mass323.06
IUPAC Name4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide
SMILESCCC(CS(=O)(=O)Nc1ccnc(S(N)(=O)=O)c1)OC
InChIInChI=1S/C10H17N3O5S2/c1-3-9(18-2)7-19(14,15)13-8-4-5-12-10(6-8)20(11,16)17/h4-6,9H,3,7H2,1-2H3,(H,12,13)(H2,11,16,17)
InChIKeyIUIOWZMGJMFNAO-UHFFFAOYSA-N
XLogP-0.10
TPSA128.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide?
The IUPAC name of 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide (CID 126828311) is 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide.
What is the SMILES notation for 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide?
The canonical SMILES for 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide is CCC(CS(=O)(=O)Nc1ccnc(S(N)(=O)=O)c1)OC.
What is the InChIKey of 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide?
The InChIKey is IUIOWZMGJMFNAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O5S2/c1-3-9(18-2)7-19(14,15)13-8-4-5-12-10(6-8)20(11,16)17/h4-6,9H,3,7H2,1-2H3,(H,12,13)(H2,11,16,17).
What are the key properties of 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide?
4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide has a molecular weight of 323.40 g/mol, XLogP of -0.10, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxybutylsulfonylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 126828311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).