3-chloro-N-cyclopropylpyridine-2-sulfonamide

C8H9ClN2O2S — CID 71646489

IUPAC3-chloro-N-cyclopropylpyridine-2-sulfonamide
SMILESO=S(=O)(NC1CC1)c1ncccc1Cl
InChIInChI=1S/C8H9ClN2O2S/c9-7-2-1-5-10-8(7)14(12,13)11-6-3-4-6/h1-2,5-6,11H,3-4H2
InChIKeyWIBMHYDKRUEYNA-UHFFFAOYSA-N
MW232.69 g/mol
LogP1.18
Rot. Bonds3

About 3-chloro-N-cyclopropylpyridine-2-sulfonamide

3-chloro-N-cyclopropylpyridine-2-sulfonamide (PubChem CID 71646489) has the molecular formula C8H9ClN2O2S and a molecular weight of 232.69 g/mol. Its IUPAC name is 3-chloro-N-cyclopropylpyridine-2-sulfonamide.

Molecular Properties

Compound Name3-chloro-N-cyclopropylpyridine-2-sulfonamide
PubChem CID71646489
Molecular FormulaC8H9ClN2O2S
Molecular Weight232.69 g/mol
Exact Mass232.01
IUPAC Name3-chloro-N-cyclopropylpyridine-2-sulfonamide
SMILESO=S(=O)(NC1CC1)c1ncccc1Cl
InChIInChI=1S/C8H9ClN2O2S/c9-7-2-1-5-10-8(7)14(12,13)11-6-3-4-6/h1-2,5-6,11H,3-4H2
InChIKeyWIBMHYDKRUEYNA-UHFFFAOYSA-N
XLogP1.18
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.69
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-cyclopropylpyridine-2-sulfonamide?
The IUPAC name of 3-chloro-N-cyclopropylpyridine-2-sulfonamide (CID 71646489) is 3-chloro-N-cyclopropylpyridine-2-sulfonamide.
What is the SMILES notation for 3-chloro-N-cyclopropylpyridine-2-sulfonamide?
The canonical SMILES for 3-chloro-N-cyclopropylpyridine-2-sulfonamide is O=S(=O)(NC1CC1)c1ncccc1Cl.
What is the InChIKey of 3-chloro-N-cyclopropylpyridine-2-sulfonamide?
The InChIKey is WIBMHYDKRUEYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2S/c9-7-2-1-5-10-8(7)14(12,13)11-6-3-4-6/h1-2,5-6,11H,3-4H2.
What are the key properties of 3-chloro-N-cyclopropylpyridine-2-sulfonamide?
3-chloro-N-cyclopropylpyridine-2-sulfonamide has a molecular weight of 232.69 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclopropylpyridine-2-sulfonamide is sourced from PubChem (CID 71646489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).