N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide

C13H9N3O2S — CID 2487733

IUPACN-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1ccco1
InChIInChI=1S/C13H9N3O2S/c17-12(11-5-3-7-18-11)16-13-15-10(8-19-13)9-4-1-2-6-14-9/h1-8H,(H,15,16,17)
InChIKeyVATWTDBEFFIYEH-UHFFFAOYSA-N
MW271.30 g/mol
LogP3.05
Rot. Bonds3

About N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide

N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide (PubChem CID 2487733) has the molecular formula C13H9N3O2S and a molecular weight of 271.30 g/mol. Its IUPAC name is N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide
PubChem CID2487733
Molecular FormulaC13H9N3O2S
Molecular Weight271.30 g/mol
Exact Mass271.04
IUPAC NameN-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1ccco1
InChIInChI=1S/C13H9N3O2S/c17-12(11-5-3-7-18-11)16-13-15-10(8-19-13)9-4-1-2-6-14-9/h1-8H,(H,15,16,17)
InChIKeyVATWTDBEFFIYEH-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-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide?
The IUPAC name of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide (CID 2487733) is N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide.
What is the SMILES notation for N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide?
The canonical SMILES for N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide is O=C(Nc1nc(-c2ccccn2)cs1)c1ccco1.
What is the InChIKey of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide?
The InChIKey is VATWTDBEFFIYEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O2S/c17-12(11-5-3-7-18-11)16-13-15-10(8-19-13)9-4-1-2-6-14-9/h1-8H,(H,15,16,17).
What are the key properties of N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide?
N-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-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-(4-pyridin-2-yl-1,3-thiazol-2-yl)furan-2-carboxamide is sourced from PubChem (CID 2487733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).