dibenzofuran-2-yl(phenyl)methanimine

C19H13NO — CID 167230325

IUPACdibenzofuran-2-yl(phenyl)methanimine
SMILES[H]/N=C(\c1ccccc1)c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C19H13NO/c20-19(13-6-2-1-3-7-13)14-10-11-18-16(12-14)15-8-4-5-9-17(15)21-18/h1-12,20H/b20-19+
InChIKeyNKEGEWWXTSVMKS-FMQUCBEESA-N
MW271.32 g/mol
LogP5.00
Rot. Bonds2

About dibenzofuran-2-yl(phenyl)methanimine

dibenzofuran-2-yl(phenyl)methanimine (PubChem CID 167230325) has the molecular formula C19H13NO and a molecular weight of 271.32 g/mol. Its IUPAC name is dibenzofuran-2-yl(phenyl)methanimine.

Molecular Properties

Compound Namedibenzofuran-2-yl(phenyl)methanimine
PubChem CID167230325
Molecular FormulaC19H13NO
Molecular Weight271.32 g/mol
Exact Mass271.10
IUPAC Namedibenzofuran-2-yl(phenyl)methanimine
SMILES[H]/N=C(\c1ccccc1)c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C19H13NO/c20-19(13-6-2-1-3-7-13)14-10-11-18-16(12-14)15-8-4-5-9-17(15)21-18/h1-12,20H/b20-19+
InChIKeyNKEGEWWXTSVMKS-FMQUCBEESA-N
XLogP5.00
TPSA36.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.32
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 dibenzofuran-2-yl(phenyl)methanimine?
The IUPAC name of dibenzofuran-2-yl(phenyl)methanimine (CID 167230325) is dibenzofuran-2-yl(phenyl)methanimine.
What is the SMILES notation for dibenzofuran-2-yl(phenyl)methanimine?
The canonical SMILES for dibenzofuran-2-yl(phenyl)methanimine is [H]/N=C(\c1ccccc1)c1ccc2oc3ccccc3c2c1.
What is the InChIKey of dibenzofuran-2-yl(phenyl)methanimine?
The InChIKey is NKEGEWWXTSVMKS-FMQUCBEESA-N. The full InChI is InChI=1S/C19H13NO/c20-19(13-6-2-1-3-7-13)14-10-11-18-16(12-14)15-8-4-5-9-17(15)21-18/h1-12,20H/b20-19+.
What are the key properties of dibenzofuran-2-yl(phenyl)methanimine?
dibenzofuran-2-yl(phenyl)methanimine has a molecular weight of 271.32 g/mol, XLogP of 5.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-2-yl(phenyl)methanimine is sourced from PubChem (CID 167230325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).