2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide

C19H11F2N3O3 — CID 135347098

IUPAC2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide
SMILESO=C(Nc1cccc(-c2nnc(-c3ccco3)o2)c1F)c1ccccc1F
InChIInChI=1S/C19H11F2N3O3/c20-13-7-2-1-5-11(13)17(25)22-14-8-3-6-12(16(14)21)18-23-24-19(27-18)15-9-4-10-26-15/h1-10H,(H,22,25)
InChIKeyQFIRLEUBCBDRJE-UHFFFAOYSA-N
MW367.31 g/mol
LogP4.53
Rot. Bonds4

About 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide

2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide (PubChem CID 135347098) has the molecular formula C19H11F2N3O3 and a molecular weight of 367.31 g/mol. Its IUPAC name is 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide
PubChem CID135347098
Molecular FormulaC19H11F2N3O3
Molecular Weight367.31 g/mol
Exact Mass367.08
IUPAC Name2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide
SMILESO=C(Nc1cccc(-c2nnc(-c3ccco3)o2)c1F)c1ccccc1F
InChIInChI=1S/C19H11F2N3O3/c20-13-7-2-1-5-11(13)17(25)22-14-8-3-6-12(16(14)21)18-23-24-19(27-18)15-9-4-10-26-15/h1-10H,(H,22,25)
InChIKeyQFIRLEUBCBDRJE-UHFFFAOYSA-N
XLogP4.53
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.31
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide (CID 135347098) is 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide is O=C(Nc1cccc(-c2nnc(-c3ccco3)o2)c1F)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide?
The InChIKey is QFIRLEUBCBDRJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F2N3O3/c20-13-7-2-1-5-11(13)17(25)22-14-8-3-6-12(16(14)21)18-23-24-19(27-18)15-9-4-10-26-15/h1-10H,(H,22,25).
What are the key properties of 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide?
2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide has a molecular weight of 367.31 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-fluoro-3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]benzamide is sourced from PubChem (CID 135347098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).