2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

C13H9N5OS — CID 10125423

IUPAC2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESNc1nc(-c2cccs2)cc2nc(-c3ccco3)nn12
InChIInChI=1S/C13H9N5OS/c14-13-15-8(10-4-2-6-20-10)7-11-16-12(17-18(11)13)9-3-1-5-19-9/h1-7H,(H2,14,15)
InChIKeyNLPXLLBURLJVML-UHFFFAOYSA-N
MW283.32 g/mol
LogP2.69
Rot. Bonds2

About 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (PubChem CID 10125423) has the molecular formula C13H9N5OS and a molecular weight of 283.32 g/mol. Its IUPAC name is 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
PubChem CID10125423
Molecular FormulaC13H9N5OS
Molecular Weight283.32 g/mol
Exact Mass283.05
IUPAC Name2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESNc1nc(-c2cccs2)cc2nc(-c3ccco3)nn12
InChIInChI=1S/C13H9N5OS/c14-13-15-8(10-4-2-6-20-10)7-11-16-12(17-18(11)13)9-3-1-5-19-9/h1-7H,(H2,14,15)
InChIKeyNLPXLLBURLJVML-UHFFFAOYSA-N
XLogP2.69
TPSA82.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (CID 10125423) is 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is Nc1nc(-c2cccs2)cc2nc(-c3ccco3)nn12.
What is the InChIKey of 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The InChIKey is NLPXLLBURLJVML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5OS/c14-13-15-8(10-4-2-6-20-10)7-11-16-12(17-18(11)13)9-3-1-5-19-9/h1-7H,(H2,14,15).
What are the key properties of 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine has a molecular weight of 283.32 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-7-thiophen-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 10125423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).