3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide

C12H18FN3O3S — CID 103299517

IUPAC3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide
SMILESCC(CN1CCOCC1)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C12H18FN3O3S/c1-10(9-16-5-7-19-8-6-16)15-20(17,18)12-11(13)3-2-4-14-12/h2-4,10,15H,5-9H2,1H3
InChIKeyXARWKEOOCPJLMA-UHFFFAOYSA-N
MW303.36 g/mol
LogP0.22
Rot. Bonds5

About 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide

3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide (PubChem CID 103299517) has the molecular formula C12H18FN3O3S and a molecular weight of 303.36 g/mol. Its IUPAC name is 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide
PubChem CID103299517
Molecular FormulaC12H18FN3O3S
Molecular Weight303.36 g/mol
Exact Mass303.11
IUPAC Name3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide
SMILESCC(CN1CCOCC1)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C12H18FN3O3S/c1-10(9-16-5-7-19-8-6-16)15-20(17,18)12-11(13)3-2-4-14-12/h2-4,10,15H,5-9H2,1H3
InChIKeyXARWKEOOCPJLMA-UHFFFAOYSA-N
XLogP0.22
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide (CID 103299517) is 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide is CC(CN1CCOCC1)NS(=O)(=O)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide?
The InChIKey is XARWKEOOCPJLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN3O3S/c1-10(9-16-5-7-19-8-6-16)15-20(17,18)12-11(13)3-2-4-14-12/h2-4,10,15H,5-9H2,1H3.
What are the key properties of 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide?
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide has a molecular weight of 303.36 g/mol, XLogP of 0.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 103299517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).