5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide

C10H13FN2O3S — CID 115754017

IUPAC5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide
SMILESO=S(=O)(NCC1(O)CCC1)c1cncc(F)c1
InChIInChI=1S/C10H13FN2O3S/c11-8-4-9(6-12-5-8)17(15,16)13-7-10(14)2-1-3-10/h4-6,13-14H,1-3,7H2
InChIKeyQHYTWRWEJNCARL-UHFFFAOYSA-N
MW260.29 g/mol
LogP0.41
Rot. Bonds4

About 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide

5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide (PubChem CID 115754017) has the molecular formula C10H13FN2O3S and a molecular weight of 260.29 g/mol. Its IUPAC name is 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide
PubChem CID115754017
Molecular FormulaC10H13FN2O3S
Molecular Weight260.29 g/mol
Exact Mass260.06
IUPAC Name5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide
SMILESO=S(=O)(NCC1(O)CCC1)c1cncc(F)c1
InChIInChI=1S/C10H13FN2O3S/c11-8-4-9(6-12-5-8)17(15,16)13-7-10(14)2-1-3-10/h4-6,13-14H,1-3,7H2
InChIKeyQHYTWRWEJNCARL-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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Related Compounds

1-[[(5-fluoro-3-pyridinyl)sulfonylamino]methyl]cyclopropane-1-carboxylic acid
CID 113312114
5-fluoro-N-[1-(hydroxymethyl)cyclobutyl]pyridine-3-sulfonamide
CID 113431326
3-amino-4-fluoro-N-[(1-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 65103398
3-amino-N-[(1-hydroxycyclobutyl)methyl]benzenesulfonamide
CID 113498452
5-fluoro-N-(3-hydroxy-2-methylpropyl)pyridine-3-sulfonamide
CID 65034557
3,4-dichloro-N-[(1-hydroxycyclohexyl)methyl]benzenesulfonamide
CID 65117612
4-fluoro-N-[(1-hydroxycyclohexyl)methyl]-2,6-dimethylbenzenesulfonamide
CID 107327238
5-fluoro-N-[3-(hydroxymethyl)pentan-3-yl]pyridine-3-sulfonamide
CID 62521778
N-[2-(cyclopropylamino)ethyl]-5-fluoropyridine-3-sulfonamide
CID 62664626
5-fluoro-N-[(3-hydroxycyclohexyl)methyl]pyridine-3-sulfonamide
CID 103835856
N-[(E)-4-chlorobut-2-enyl]-5-fluoropyridine-3-sulfonamide
CID 81429639
3-amino-5-fluoro-N-[(1-hydroxycyclopentyl)methyl]-4-methylbenzenesulfonamide
CID 116791950

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide (CID 115754017) is 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide is O=S(=O)(NCC1(O)CCC1)c1cncc(F)c1.
What is the InChIKey of 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide?
The InChIKey is QHYTWRWEJNCARL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S/c11-8-4-9(6-12-5-8)17(15,16)13-7-10(14)2-1-3-10/h4-6,13-14H,1-3,7H2.
What are the key properties of 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide?
5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-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 5-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 115754017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).