1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide

C10H9FN2O3S — CID 75483842

IUPAC1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide
SMILESO=S(=O)(Cc1cccc(F)c1)Nc1ccon1
InChIInChI=1S/C10H9FN2O3S/c11-9-3-1-2-8(6-9)7-17(14,15)13-10-4-5-16-12-10/h1-6H,7H2,(H,12,13)
InChIKeyBXQOUDLLBDYBEJ-UHFFFAOYSA-N
MW256.26 g/mol
LogP1.76
Rot. Bonds4

About 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide

1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide (PubChem CID 75483842) has the molecular formula C10H9FN2O3S and a molecular weight of 256.26 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide.

Molecular Properties

Compound Name1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide
PubChem CID75483842
Molecular FormulaC10H9FN2O3S
Molecular Weight256.26 g/mol
Exact Mass256.03
IUPAC Name1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide
SMILESO=S(=O)(Cc1cccc(F)c1)Nc1ccon1
InChIInChI=1S/C10H9FN2O3S/c11-9-3-1-2-8(6-9)7-17(14,15)13-10-4-5-16-12-10/h1-6H,7H2,(H,12,13)
InChIKeyBXQOUDLLBDYBEJ-UHFFFAOYSA-N
XLogP1.76
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide?
The IUPAC name of 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide (CID 75483842) is 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide.
What is the SMILES notation for 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide?
The canonical SMILES for 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide is O=S(=O)(Cc1cccc(F)c1)Nc1ccon1.
What is the InChIKey of 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide?
The InChIKey is BXQOUDLLBDYBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O3S/c11-9-3-1-2-8(6-9)7-17(14,15)13-10-4-5-16-12-10/h1-6H,7H2,(H,12,13).
What are the key properties of 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide?
1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide has a molecular weight of 256.26 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-N-(1,2-oxazol-3-yl)methanesulfonamide is sourced from PubChem (CID 75483842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).