7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine

C11H10N4O — CID 13424971

IUPAC7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCc1nc(C)n2nc(-c3ccco3)cc2n1
InChIInChI=1S/C11H10N4O/c1-7-12-8(2)15-11(13-7)6-9(14-15)10-4-3-5-16-10/h3-6H,1-2H3
InChIKeyZAMOZEQKJZHEJB-UHFFFAOYSA-N
MW214.23 g/mol
LogP2.00
Rot. Bonds1

About 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine

7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine (PubChem CID 13424971) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine.

Molecular Properties

Compound Name7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
PubChem CID13424971
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCc1nc(C)n2nc(-c3ccco3)cc2n1
InChIInChI=1S/C11H10N4O/c1-7-12-8(2)15-11(13-7)6-9(14-15)10-4-3-5-16-10/h3-6H,1-2H3
InChIKeyZAMOZEQKJZHEJB-UHFFFAOYSA-N
XLogP2.00
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
The IUPAC name of 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine (CID 13424971) is 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine.
What is the SMILES notation for 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
The canonical SMILES for 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine is Cc1nc(C)n2nc(-c3ccco3)cc2n1.
What is the InChIKey of 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
The InChIKey is ZAMOZEQKJZHEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c1-7-12-8(2)15-11(13-7)6-9(14-15)10-4-3-5-16-10/h3-6H,1-2H3.
What are the key properties of 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine has a molecular weight of 214.23 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine is sourced from PubChem (CID 13424971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).