2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide

C14H10FN3O3S — CID 53143380

IUPAC2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(-c2cccnc2)no1)c1ccccc1F
InChIInChI=1S/C14H10FN3O3S/c15-11-5-1-2-6-13(11)22(19,20)18-14-8-12(17-21-14)10-4-3-7-16-9-10/h1-9,18H
InChIKeyBNDLHCPZPKXECU-UHFFFAOYSA-N
MW319.32 g/mol
LogP2.68
Rot. Bonds4

About 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide

2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide (PubChem CID 53143380) has the molecular formula C14H10FN3O3S and a molecular weight of 319.32 g/mol. Its IUPAC name is 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide
PubChem CID53143380
Molecular FormulaC14H10FN3O3S
Molecular Weight319.32 g/mol
Exact Mass319.04
IUPAC Name2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(-c2cccnc2)no1)c1ccccc1F
InChIInChI=1S/C14H10FN3O3S/c15-11-5-1-2-6-13(11)22(19,20)18-14-8-12(17-21-14)10-4-3-7-16-9-10/h1-9,18H
InChIKeyBNDLHCPZPKXECU-UHFFFAOYSA-N
XLogP2.68
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide?
The IUPAC name of 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide (CID 53143380) is 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide?
The canonical SMILES for 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide is O=S(=O)(Nc1cc(-c2cccnc2)no1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide?
The InChIKey is BNDLHCPZPKXECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O3S/c15-11-5-1-2-6-13(11)22(19,20)18-14-8-12(17-21-14)10-4-3-7-16-9-10/h1-9,18H.
What are the key properties of 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide?
2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide has a molecular weight of 319.32 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 53143380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).