6-amino-N-cyclobutylpyridine-3-sulfonamide

C9H13N3O2S — CID 62414646

IUPAC6-amino-N-cyclobutylpyridine-3-sulfonamide
SMILESNc1ccc(S(=O)(=O)NC2CCC2)cn1
InChIInChI=1S/C9H13N3O2S/c10-9-5-4-8(6-11-9)15(13,14)12-7-2-1-3-7/h4-7,12H,1-3H2,(H2,10,11)
InChIKeyMFAJRDVEGBEXRL-UHFFFAOYSA-N
MW227.29 g/mol
LogP0.49
Rot. Bonds3

About 6-amino-N-cyclobutylpyridine-3-sulfonamide

6-amino-N-cyclobutylpyridine-3-sulfonamide (PubChem CID 62414646) has the molecular formula C9H13N3O2S and a molecular weight of 227.29 g/mol. Its IUPAC name is 6-amino-N-cyclobutylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-cyclobutylpyridine-3-sulfonamide
PubChem CID62414646
Molecular FormulaC9H13N3O2S
Molecular Weight227.29 g/mol
Exact Mass227.07
IUPAC Name6-amino-N-cyclobutylpyridine-3-sulfonamide
SMILESNc1ccc(S(=O)(=O)NC2CCC2)cn1
InChIInChI=1S/C9H13N3O2S/c10-9-5-4-8(6-11-9)15(13,14)12-7-2-1-3-7/h4-7,12H,1-3H2,(H2,10,11)
InChIKeyMFAJRDVEGBEXRL-UHFFFAOYSA-N
XLogP0.49
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.29
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-cyclobutylpyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-cyclobutylpyridine-3-sulfonamide (CID 62414646) is 6-amino-N-cyclobutylpyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-cyclobutylpyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-cyclobutylpyridine-3-sulfonamide is Nc1ccc(S(=O)(=O)NC2CCC2)cn1.
What is the InChIKey of 6-amino-N-cyclobutylpyridine-3-sulfonamide?
The InChIKey is MFAJRDVEGBEXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2S/c10-9-5-4-8(6-11-9)15(13,14)12-7-2-1-3-7/h4-7,12H,1-3H2,(H2,10,11).
What are the key properties of 6-amino-N-cyclobutylpyridine-3-sulfonamide?
6-amino-N-cyclobutylpyridine-3-sulfonamide has a molecular weight of 227.29 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-cyclobutylpyridine-3-sulfonamide is sourced from PubChem (CID 62414646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).