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

C14H10FN3O2S — CID 110322286

IUPAC2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
SMILESO=C(NCc1nnc(-c2cccs2)o1)c1ccccc1F
InChIInChI=1S/C14H10FN3O2S/c15-10-5-2-1-4-9(10)13(19)16-8-12-17-18-14(20-12)11-6-3-7-21-11/h1-7H,8H2,(H,16,19)
InChIKeyLKQMTDJCKZJQHM-UHFFFAOYSA-N
MW303.32 g/mol
LogP2.87
Rot. Bonds4

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

2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide (PubChem CID 110322286) has the molecular formula C14H10FN3O2S and a molecular weight of 303.32 g/mol. Its IUPAC name is 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
PubChem CID110322286
Molecular FormulaC14H10FN3O2S
Molecular Weight303.32 g/mol
Exact Mass303.05
IUPAC Name2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
SMILESO=C(NCc1nnc(-c2cccs2)o1)c1ccccc1F
InChIInChI=1S/C14H10FN3O2S/c15-10-5-2-1-4-9(10)13(19)16-8-12-17-18-14(20-12)11-6-3-7-21-11/h1-7H,8H2,(H,16,19)
InChIKeyLKQMTDJCKZJQHM-UHFFFAOYSA-N
XLogP2.87
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide?
The IUPAC name of 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide (CID 110322286) is 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide?
The canonical SMILES for 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide is O=C(NCc1nnc(-c2cccs2)o1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide?
The InChIKey is LKQMTDJCKZJQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2S/c15-10-5-2-1-4-9(10)13(19)16-8-12-17-18-14(20-12)11-6-3-7-21-11/h1-7H,8H2,(H,16,19).
What are the key properties of 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide?
2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide has a molecular weight of 303.32 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide is sourced from PubChem (CID 110322286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).