N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide

C13H9N3O2S — CID 53143108

IUPACN-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide
SMILESO=C(Nc1cc(-c2ccccn2)no1)c1cccs1
InChIInChI=1S/C13H9N3O2S/c17-13(11-5-3-7-19-11)15-12-8-10(16-18-12)9-4-1-2-6-14-9/h1-8H,(H,15,17)
InChIKeyIJXLRVUFSXKOHE-UHFFFAOYSA-N
MW271.30 g/mol
LogP3.05
Rot. Bonds3

About N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide

N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide (PubChem CID 53143108) has the molecular formula C13H9N3O2S and a molecular weight of 271.30 g/mol. Its IUPAC name is N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide
PubChem CID53143108
Molecular FormulaC13H9N3O2S
Molecular Weight271.30 g/mol
Exact Mass271.04
IUPAC NameN-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide
SMILESO=C(Nc1cc(-c2ccccn2)no1)c1cccs1
InChIInChI=1S/C13H9N3O2S/c17-13(11-5-3-7-19-11)15-12-8-10(16-18-12)9-4-1-2-6-14-9/h1-8H,(H,15,17)
InChIKeyIJXLRVUFSXKOHE-UHFFFAOYSA-N
XLogP3.05
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide?
The IUPAC name of N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide (CID 53143108) is N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide is O=C(Nc1cc(-c2ccccn2)no1)c1cccs1.
What is the InChIKey of N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide?
The InChIKey is IJXLRVUFSXKOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O2S/c17-13(11-5-3-7-19-11)15-12-8-10(16-18-12)9-4-1-2-6-14-9/h1-8H,(H,15,17).
What are the key properties of N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide?
N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide has a molecular weight of 271.30 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyridin-2-yl-1,2-oxazol-5-yl)thiophene-2-carboxamide is sourced from PubChem (CID 53143108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).