N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine

C18H15NOS — CID 90459317

IUPACN-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine
SMILESCOc1ccccc1/N=C(\c1ccccc1)c1ccsc1
InChIInChI=1S/C18H15NOS/c1-20-17-10-6-5-9-16(17)19-18(15-11-12-21-13-15)14-7-3-2-4-8-14/h2-13H,1H3/b19-18+
InChIKeyOEFHXHADXIPACL-VHEBQXMUSA-N
MW293.39 g/mol
LogP4.93
Rot. Bonds4

About N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine

N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine (PubChem CID 90459317) has the molecular formula C18H15NOS and a molecular weight of 293.39 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine
PubChem CID90459317
Molecular FormulaC18H15NOS
Molecular Weight293.39 g/mol
Exact Mass293.09
IUPAC NameN-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine
SMILESCOc1ccccc1/N=C(\c1ccccc1)c1ccsc1
InChIInChI=1S/C18H15NOS/c1-20-17-10-6-5-9-16(17)19-18(15-11-12-21-13-15)14-7-3-2-4-8-14/h2-13H,1H3/b19-18+
InChIKeyOEFHXHADXIPACL-VHEBQXMUSA-N
XLogP4.93
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine 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-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine?
The IUPAC name of N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine (CID 90459317) is N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine.
What is the SMILES notation for N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine?
The canonical SMILES for N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine is COc1ccccc1/N=C(\c1ccccc1)c1ccsc1.
What is the InChIKey of N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine?
The InChIKey is OEFHXHADXIPACL-VHEBQXMUSA-N. The full InChI is InChI=1S/C18H15NOS/c1-20-17-10-6-5-9-16(17)19-18(15-11-12-21-13-15)14-7-3-2-4-8-14/h2-13H,1H3/b19-18+.
What are the key properties of N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine?
N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine has a molecular weight of 293.39 g/mol, XLogP of 4.93, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-1-phenyl-1-thiophen-3-ylmethanimine is sourced from PubChem (CID 90459317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).