3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide

C15H12FN3O2S — CID 16590472

IUPAC3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccc(F)cc2)o1)Nc1nccs1
InChIInChI=1S/C15H12FN3O2S/c16-11-3-1-10(2-4-11)12-9-18-14(21-12)6-5-13(20)19-15-17-7-8-22-15/h1-4,7-9H,5-6H2,(H,17,19,20)
InChIKeyQMVIXCLAXJXIRA-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.51
Rot. Bonds5

About 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide

3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 16590472) has the molecular formula C15H12FN3O2S and a molecular weight of 317.35 g/mol. Its IUPAC name is 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide
PubChem CID16590472
Molecular FormulaC15H12FN3O2S
Molecular Weight317.35 g/mol
Exact Mass317.06
IUPAC Name3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccc(F)cc2)o1)Nc1nccs1
InChIInChI=1S/C15H12FN3O2S/c16-11-3-1-10(2-4-11)12-9-18-14(21-12)6-5-13(20)19-15-17-7-8-22-15/h1-4,7-9H,5-6H2,(H,17,19,20)
InChIKeyQMVIXCLAXJXIRA-UHFFFAOYSA-N
XLogP3.51
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide (CID 16590472) is 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide is O=C(CCc1ncc(-c2ccc(F)cc2)o1)Nc1nccs1.
What is the InChIKey of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is QMVIXCLAXJXIRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O2S/c16-11-3-1-10(2-4-11)12-9-18-14(21-12)6-5-13(20)19-15-17-7-8-22-15/h1-4,7-9H,5-6H2,(H,17,19,20).
What are the key properties of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide?
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 317.35 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 16590472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).