5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine

C15H17N3O — CID 12720209

IUPAC5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine
SMILESCC1(C)OC(C)(C)c2nc(-c3ccccc3)nnc21
InChIInChI=1S/C15H17N3O/c1-14(2)11-12(15(3,4)19-14)17-18-13(16-11)10-8-6-5-7-9-10/h5-9H,1-4H3
InChIKeyOJVFWXSWSBEQRL-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.04
Rot. Bonds1

About 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine

5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine (PubChem CID 12720209) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine.

Molecular Properties

Compound Name5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine
PubChem CID12720209
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine
SMILESCC1(C)OC(C)(C)c2nc(-c3ccccc3)nnc21
InChIInChI=1S/C15H17N3O/c1-14(2)11-12(15(3,4)19-14)17-18-13(16-11)10-8-6-5-7-9-10/h5-9H,1-4H3
InChIKeyOJVFWXSWSBEQRL-UHFFFAOYSA-N
XLogP3.04
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine?
The IUPAC name of 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine (CID 12720209) is 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine.
What is the SMILES notation for 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine?
The canonical SMILES for 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine is CC1(C)OC(C)(C)c2nc(-c3ccccc3)nnc21.
What is the InChIKey of 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine?
The InChIKey is OJVFWXSWSBEQRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-14(2)11-12(15(3,4)19-14)17-18-13(16-11)10-8-6-5-7-9-10/h5-9H,1-4H3.
What are the key properties of 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine?
5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine has a molecular weight of 255.32 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,7,7-tetramethyl-3-phenylfuro[3,4-e][1,2,4]triazine is sourced from PubChem (CID 12720209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).