1-(1-benzofuran-2-yl)-N-phenylmethanimine

C15H11NO — CID 102313408

IUPAC1-(1-benzofuran-2-yl)-N-phenylmethanimine
SMILESC(=N/c1ccccc1)\c1cc2ccccc2o1
InChIInChI=1S/C15H11NO/c1-2-7-13(8-3-1)16-11-14-10-12-6-4-5-9-15(12)17-14/h1-11H/b16-11+
InChIKeyCSEJIJCZVNHDKM-LFIBNONCSA-N
MW221.26 g/mol
LogP4.18
Rot. Bonds2

About 1-(1-benzofuran-2-yl)-N-phenylmethanimine

1-(1-benzofuran-2-yl)-N-phenylmethanimine (PubChem CID 102313408) has the molecular formula C15H11NO and a molecular weight of 221.26 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-N-phenylmethanimine.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-N-phenylmethanimine
PubChem CID102313408
Molecular FormulaC15H11NO
Molecular Weight221.26 g/mol
Exact Mass221.08
IUPAC Name1-(1-benzofuran-2-yl)-N-phenylmethanimine
SMILESC(=N/c1ccccc1)\c1cc2ccccc2o1
InChIInChI=1S/C15H11NO/c1-2-7-13(8-3-1)16-11-14-10-12-6-4-5-9-15(12)17-14/h1-11H/b16-11+
InChIKeyCSEJIJCZVNHDKM-LFIBNONCSA-N
XLogP4.18
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(1-benzofuran-2-yl)-N-phenylmethanimine with MolForge

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

Launch Full Analysis

Related Compounds

N-[(E)-1-benzofuran-2-ylmethylideneamino]-N-methylmethanamine;N,N-dimethylmethanamine;ethane
CID 172921772
2-ethenyl-1-benzofuran
CID 588974
(NE,R)-N-(1-benzofuran-2-ylmethylidene)-2-methylpropane-2-sulfinamide
CID 155662884
dichloroiron;1-[5-[(4-methylphenyl)iminomethyl]furan-2-yl]-N-phenylmethanimine
CID 20702065
1-benzofuran-2-carbaldehyde;methanamine
CID 143075109
N-(1-benzofuran-2-ylmethylideneamino)-2-methyl-3-phenylprop-2-enamide
CID 6735281
ethane;1-(furan-2-yl)-N-phenylmethanimine
CID 160534475
N-[(E)-1-benzofuran-2-ylmethylideneamino]-2-(dimethylamino)acetamide
CID 20843932
N-[(E)-1-benzofuran-2-ylmethylideneamino]-3-hydroxynaphthalene-2-carboxamide
CID 45109193
N,1-diphenylmethanimine
CID 10858
(E)-3-(1-benzofuran-2-yl)-2-methylprop-2-enenitrile
CID 18339198
2-(3-bromo-2-methylprop-1-enyl)-1-benzofuran
CID 79322987

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-N-phenylmethanimine?
The IUPAC name of 1-(1-benzofuran-2-yl)-N-phenylmethanimine (CID 102313408) is 1-(1-benzofuran-2-yl)-N-phenylmethanimine.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-N-phenylmethanimine?
The canonical SMILES for 1-(1-benzofuran-2-yl)-N-phenylmethanimine is C(=N/c1ccccc1)\c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-N-phenylmethanimine?
The InChIKey is CSEJIJCZVNHDKM-LFIBNONCSA-N. The full InChI is InChI=1S/C15H11NO/c1-2-7-13(8-3-1)16-11-14-10-12-6-4-5-9-15(12)17-14/h1-11H/b16-11+.
What are the key properties of 1-(1-benzofuran-2-yl)-N-phenylmethanimine?
1-(1-benzofuran-2-yl)-N-phenylmethanimine has a molecular weight of 221.26 g/mol, XLogP of 4.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-N-phenylmethanimine is sourced from PubChem (CID 102313408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).