N-(1,2,4-triazol-4-yl)fluoren-9-imine

C15H10N4 — CID 2312923

IUPACN-(1,2,4-triazol-4-yl)fluoren-9-imine
SMILESc1ccc2c(c1)C(=Nn1cnnc1)c1ccccc1-2
InChIInChI=1S/C15H10N4/c1-3-7-13-11(5-1)12-6-2-4-8-14(12)15(13)18-19-9-16-17-10-19/h1-10H
InChIKeyHQEGXAVUFIQMCR-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.56
Rot. Bonds1

About N-(1,2,4-triazol-4-yl)fluoren-9-imine

N-(1,2,4-triazol-4-yl)fluoren-9-imine (PubChem CID 2312923) has the molecular formula C15H10N4 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-(1,2,4-triazol-4-yl)fluoren-9-imine.

Molecular Properties

Compound NameN-(1,2,4-triazol-4-yl)fluoren-9-imine
PubChem CID2312923
Molecular FormulaC15H10N4
Molecular Weight246.27 g/mol
Exact Mass246.09
IUPAC NameN-(1,2,4-triazol-4-yl)fluoren-9-imine
SMILESc1ccc2c(c1)C(=Nn1cnnc1)c1ccccc1-2
InChIInChI=1S/C15H10N4/c1-3-7-13-11(5-1)12-6-2-4-8-14(12)15(13)18-19-9-16-17-10-19/h1-10H
InChIKeyHQEGXAVUFIQMCR-UHFFFAOYSA-N
XLogP2.56
TPSA43.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,4-triazol-4-yl)fluoren-9-imine?
The IUPAC name of N-(1,2,4-triazol-4-yl)fluoren-9-imine (CID 2312923) is N-(1,2,4-triazol-4-yl)fluoren-9-imine.
What is the SMILES notation for N-(1,2,4-triazol-4-yl)fluoren-9-imine?
The canonical SMILES for N-(1,2,4-triazol-4-yl)fluoren-9-imine is c1ccc2c(c1)C(=Nn1cnnc1)c1ccccc1-2.
What is the InChIKey of N-(1,2,4-triazol-4-yl)fluoren-9-imine?
The InChIKey is HQEGXAVUFIQMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4/c1-3-7-13-11(5-1)12-6-2-4-8-14(12)15(13)18-19-9-16-17-10-19/h1-10H.
What are the key properties of N-(1,2,4-triazol-4-yl)fluoren-9-imine?
N-(1,2,4-triazol-4-yl)fluoren-9-imine has a molecular weight of 246.27 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,4-triazol-4-yl)fluoren-9-imine is sourced from PubChem (CID 2312923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).