6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide

C8H10ClN3O2S — CID 64607555

IUPAC6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)NC2CC2)cc1Cl
InChIInChI=1S/C8H10ClN3O2S/c9-7-3-6(4-11-8(7)10)15(13,14)12-5-1-2-5/h3-5,12H,1-2H2,(H2,10,11)
InChIKeyXLRGQQAHZLIGCU-UHFFFAOYSA-N
MW247.71 g/mol
LogP0.76
Rot. Bonds3

About 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide

6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide (PubChem CID 64607555) has the molecular formula C8H10ClN3O2S and a molecular weight of 247.71 g/mol. Its IUPAC name is 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide
PubChem CID64607555
Molecular FormulaC8H10ClN3O2S
Molecular Weight247.71 g/mol
Exact Mass247.02
IUPAC Name6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)NC2CC2)cc1Cl
InChIInChI=1S/C8H10ClN3O2S/c9-7-3-6(4-11-8(7)10)15(13,14)12-5-1-2-5/h3-5,12H,1-2H2,(H2,10,11)
InChIKeyXLRGQQAHZLIGCU-UHFFFAOYSA-N
XLogP0.76
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.71
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide (CID 64607555) is 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide is Nc1ncc(S(=O)(=O)NC2CC2)cc1Cl.
What is the InChIKey of 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide?
The InChIKey is XLRGQQAHZLIGCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O2S/c9-7-3-6(4-11-8(7)10)15(13,14)12-5-1-2-5/h3-5,12H,1-2H2,(H2,10,11).
What are the key properties of 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide?
6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide has a molecular weight of 247.71 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide is sourced from PubChem (CID 64607555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).