1-(9-phenylfluoren-9-yl)triazole

C21H15N3 — CID 11381309

IUPAC1-(9-phenylfluoren-9-yl)triazole
SMILESc1ccc(C2(n3ccnn3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C21H15N3/c1-2-8-16(9-3-1)21(24-15-14-22-23-24)19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-15H
InChIKeySZQVIAGZXWPGLB-UHFFFAOYSA-N
MW309.37 g/mol
LogP4.10
Rot. Bonds2

About 1-(9-phenylfluoren-9-yl)triazole

1-(9-phenylfluoren-9-yl)triazole (PubChem CID 11381309) has the molecular formula C21H15N3 and a molecular weight of 309.37 g/mol. Its IUPAC name is 1-(9-phenylfluoren-9-yl)triazole.

Molecular Properties

Compound Name1-(9-phenylfluoren-9-yl)triazole
PubChem CID11381309
Molecular FormulaC21H15N3
Molecular Weight309.37 g/mol
Exact Mass309.13
IUPAC Name1-(9-phenylfluoren-9-yl)triazole
SMILESc1ccc(C2(n3ccnn3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C21H15N3/c1-2-8-16(9-3-1)21(24-15-14-22-23-24)19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-15H
InChIKeySZQVIAGZXWPGLB-UHFFFAOYSA-N
XLogP4.10
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(9-phenylfluoren-9-yl)triazole?
The IUPAC name of 1-(9-phenylfluoren-9-yl)triazole (CID 11381309) is 1-(9-phenylfluoren-9-yl)triazole.
What is the SMILES notation for 1-(9-phenylfluoren-9-yl)triazole?
The canonical SMILES for 1-(9-phenylfluoren-9-yl)triazole is c1ccc(C2(n3ccnn3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 1-(9-phenylfluoren-9-yl)triazole?
The InChIKey is SZQVIAGZXWPGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3/c1-2-8-16(9-3-1)21(24-15-14-22-23-24)19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-15H.
What are the key properties of 1-(9-phenylfluoren-9-yl)triazole?
1-(9-phenylfluoren-9-yl)triazole has a molecular weight of 309.37 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9-phenylfluoren-9-yl)triazole is sourced from PubChem (CID 11381309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).