3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide

C10H13FN2O3S — CID 103300487

IUPAC3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide
SMILESO=S(=O)(NC1(CO)CCC1)c1ncccc1F
InChIInChI=1S/C10H13FN2O3S/c11-8-3-1-6-12-9(8)17(15,16)13-10(7-14)4-2-5-10/h1,3,6,13-14H,2,4-5,7H2
InChIKeyTZACQMQXJCYMEH-UHFFFAOYSA-N
MW260.29 g/mol
LogP0.41
Rot. Bonds4

About 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide

3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide (PubChem CID 103300487) has the molecular formula C10H13FN2O3S and a molecular weight of 260.29 g/mol. Its IUPAC name is 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide
PubChem CID103300487
Molecular FormulaC10H13FN2O3S
Molecular Weight260.29 g/mol
Exact Mass260.06
IUPAC Name3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide
SMILESO=S(=O)(NC1(CO)CCC1)c1ncccc1F
InChIInChI=1S/C10H13FN2O3S/c11-8-3-1-6-12-9(8)17(15,16)13-10(7-14)4-2-5-10/h1,3,6,13-14H,2,4-5,7H2
InChIKeyTZACQMQXJCYMEH-UHFFFAOYSA-N
XLogP0.41
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide?
The IUPAC name of 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide (CID 103300487) is 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide.
What is the SMILES notation for 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide?
The canonical SMILES for 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide is O=S(=O)(NC1(CO)CCC1)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide?
The InChIKey is TZACQMQXJCYMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S/c11-8-3-1-6-12-9(8)17(15,16)13-10(7-14)4-2-5-10/h1,3,6,13-14H,2,4-5,7H2.
What are the key properties of 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide?
3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide has a molecular weight of 260.29 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-2-sulfonamide is sourced from PubChem (CID 103300487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).