N-(benzhydrylideneamino)fluoren-9-imine

C26H18N2 — CID 57425821

IUPACN-(benzhydrylideneamino)fluoren-9-imine
SMILESc1ccc(C(=NN=C2c3ccccc3-c3ccccc32)c2ccccc2)cc1
InChIInChI=1S/C26H18N2/c1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)27-28-26-23-17-9-7-15-21(23)22-16-8-10-18-24(22)26/h1-18H
InChIKeyTUJFXCFIDLKSLF-UHFFFAOYSA-N
MW358.44 g/mol
LogP5.96
Rot. Bonds3

About N-(benzhydrylideneamino)fluoren-9-imine

N-(benzhydrylideneamino)fluoren-9-imine (PubChem CID 57425821) has the molecular formula C26H18N2 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-(benzhydrylideneamino)fluoren-9-imine.

Molecular Properties

Compound NameN-(benzhydrylideneamino)fluoren-9-imine
PubChem CID57425821
Molecular FormulaC26H18N2
Molecular Weight358.44 g/mol
Exact Mass358.15
IUPAC NameN-(benzhydrylideneamino)fluoren-9-imine
SMILESc1ccc(C(=NN=C2c3ccccc3-c3ccccc32)c2ccccc2)cc1
InChIInChI=1S/C26H18N2/c1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)27-28-26-23-17-9-7-15-21(23)22-16-8-10-18-24(22)26/h1-18H
InChIKeyTUJFXCFIDLKSLF-UHFFFAOYSA-N
XLogP5.96
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 55.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(benzhydrylideneamino)fluoren-9-imine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(benzhydrylideneamino)fluoren-9-imine?
The IUPAC name of N-(benzhydrylideneamino)fluoren-9-imine (CID 57425821) is N-(benzhydrylideneamino)fluoren-9-imine.
What is the SMILES notation for N-(benzhydrylideneamino)fluoren-9-imine?
The canonical SMILES for N-(benzhydrylideneamino)fluoren-9-imine is c1ccc(C(=NN=C2c3ccccc3-c3ccccc32)c2ccccc2)cc1.
What is the InChIKey of N-(benzhydrylideneamino)fluoren-9-imine?
The InChIKey is TUJFXCFIDLKSLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2/c1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)27-28-26-23-17-9-7-15-21(23)22-16-8-10-18-24(22)26/h1-18H.
What are the key properties of N-(benzhydrylideneamino)fluoren-9-imine?
N-(benzhydrylideneamino)fluoren-9-imine has a molecular weight of 358.44 g/mol, XLogP of 5.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzhydrylideneamino)fluoren-9-imine is sourced from PubChem (CID 57425821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).