N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide

C19H12FN3O2S — CID 139825854

IUPACN-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide
SMILESO=C(Nc1onc(-c2ccc(F)cc2)c1-c1ccncc1)c1cccs1
InChIInChI=1S/C19H12FN3O2S/c20-14-5-3-13(4-6-14)17-16(12-7-9-21-10-8-12)19(25-23-17)22-18(24)15-2-1-11-26-15/h1-11H,(H,22,24)
InChIKeyQJGSXQMGHHBGHC-UHFFFAOYSA-N
MW365.39 g/mol
LogP4.86
Rot. Bonds4

About N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide

N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide (PubChem CID 139825854) has the molecular formula C19H12FN3O2S and a molecular weight of 365.39 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide
PubChem CID139825854
Molecular FormulaC19H12FN3O2S
Molecular Weight365.39 g/mol
Exact Mass365.06
IUPAC NameN-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide
SMILESO=C(Nc1onc(-c2ccc(F)cc2)c1-c1ccncc1)c1cccs1
InChIInChI=1S/C19H12FN3O2S/c20-14-5-3-13(4-6-14)17-16(12-7-9-21-10-8-12)19(25-23-17)22-18(24)15-2-1-11-26-15/h1-11H,(H,22,24)
InChIKeyQJGSXQMGHHBGHC-UHFFFAOYSA-N
XLogP4.86
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide 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 N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide?
The IUPAC name of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide (CID 139825854) is N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide?
The canonical SMILES for N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide is O=C(Nc1onc(-c2ccc(F)cc2)c1-c1ccncc1)c1cccs1.
What is the InChIKey of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide?
The InChIKey is QJGSXQMGHHBGHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN3O2S/c20-14-5-3-13(4-6-14)17-16(12-7-9-21-10-8-12)19(25-23-17)22-18(24)15-2-1-11-26-15/h1-11H,(H,22,24).
What are the key properties of N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide?
N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-yl]thiophene-2-carboxamide is sourced from PubChem (CID 139825854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).