2-pyridin-2-ylsulfonyl-1,3-oxazole

C8H6N2O3S — CID 175524122

IUPAC2-pyridin-2-ylsulfonyl-1,3-oxazole
SMILESO=S(=O)(c1ccccn1)c1ncco1
InChIInChI=1S/C8H6N2O3S/c11-14(12,8-10-5-6-13-8)7-3-1-2-4-9-7/h1-6H
InChIKeyYBJBZFPXMUHIFB-UHFFFAOYSA-N
MW210.21 g/mol
LogP0.90
Rot. Bonds2

About 2-pyridin-2-ylsulfonyl-1,3-oxazole

2-pyridin-2-ylsulfonyl-1,3-oxazole (PubChem CID 175524122) has the molecular formula C8H6N2O3S and a molecular weight of 210.21 g/mol. Its IUPAC name is 2-pyridin-2-ylsulfonyl-1,3-oxazole.

Molecular Properties

Compound Name2-pyridin-2-ylsulfonyl-1,3-oxazole
PubChem CID175524122
Molecular FormulaC8H6N2O3S
Molecular Weight210.21 g/mol
Exact Mass210.01
IUPAC Name2-pyridin-2-ylsulfonyl-1,3-oxazole
SMILESO=S(=O)(c1ccccn1)c1ncco1
InChIInChI=1S/C8H6N2O3S/c11-14(12,8-10-5-6-13-8)7-3-1-2-4-9-7/h1-6H
InChIKeyYBJBZFPXMUHIFB-UHFFFAOYSA-N
XLogP0.90
TPSA73.06 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

benzene;1,3-oxazole-2-sulfonic acid
CID 175144268
1,3-oxazole-2-sulfonamide
CID 54424983
barium(2+);bis(pyridine-2-sulfonate)
CID 154925532
CID 175476137
CID 175476137
2-(pyridin-2-ylsulfonylmethylsulfonyl)pyridine
CID 139827432
2-(tribromomethylsulfonyl)pyridine
CID 159318212
bis(pyridin-2-ylsulfonyl)methanone
CID 129080912
2-[4-(trifluoromethyl)phenyl]sulfonylpyridine
CID 134863771
2-(chloromethylsulfonyl)pyridine
CID 54090294
cyclobutane;pyridine-2-sulfonamide
CID 175429056
N-[2-(pyridin-2-ylsulfonylamino)phenyl]pyridine-2-sulfonamide
CID 132544567
2-methylpropane;pyridine-2-sulfonic acid
CID 174713168

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-ylsulfonyl-1,3-oxazole?
The IUPAC name of 2-pyridin-2-ylsulfonyl-1,3-oxazole (CID 175524122) is 2-pyridin-2-ylsulfonyl-1,3-oxazole.
What is the SMILES notation for 2-pyridin-2-ylsulfonyl-1,3-oxazole?
The canonical SMILES for 2-pyridin-2-ylsulfonyl-1,3-oxazole is O=S(=O)(c1ccccn1)c1ncco1.
What is the InChIKey of 2-pyridin-2-ylsulfonyl-1,3-oxazole?
The InChIKey is YBJBZFPXMUHIFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O3S/c11-14(12,8-10-5-6-13-8)7-3-1-2-4-9-7/h1-6H.
What are the key properties of 2-pyridin-2-ylsulfonyl-1,3-oxazole?
2-pyridin-2-ylsulfonyl-1,3-oxazole has a molecular weight of 210.21 g/mol, XLogP of 0.90, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-ylsulfonyl-1,3-oxazole is sourced from PubChem (CID 175524122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).