N-ethenoxy-1,1-diphenylmethanimine

C15H13NO — CID 12982594

IUPACN-ethenoxy-1,1-diphenylmethanimine
SMILESC=CON=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H13NO/c1-2-17-16-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2-12H,1H2
InChIKeyRWNUXFSHGSKWOD-UHFFFAOYSA-N
MW223.27 g/mol
LogP3.60
Rot. Bonds4

About N-ethenoxy-1,1-diphenylmethanimine

N-ethenoxy-1,1-diphenylmethanimine (PubChem CID 12982594) has the molecular formula C15H13NO and a molecular weight of 223.27 g/mol. Its IUPAC name is N-ethenoxy-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-ethenoxy-1,1-diphenylmethanimine
PubChem CID12982594
Molecular FormulaC15H13NO
Molecular Weight223.27 g/mol
Exact Mass223.10
IUPAC NameN-ethenoxy-1,1-diphenylmethanimine
SMILESC=CON=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H13NO/c1-2-17-16-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2-12H,1H2
InChIKeyRWNUXFSHGSKWOD-UHFFFAOYSA-N
XLogP3.60
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethenoxy-1,1-diphenylmethanimine?
The IUPAC name of N-ethenoxy-1,1-diphenylmethanimine (CID 12982594) is N-ethenoxy-1,1-diphenylmethanimine.
What is the SMILES notation for N-ethenoxy-1,1-diphenylmethanimine?
The canonical SMILES for N-ethenoxy-1,1-diphenylmethanimine is C=CON=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-ethenoxy-1,1-diphenylmethanimine?
The InChIKey is RWNUXFSHGSKWOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-2-17-16-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2-12H,1H2.
What are the key properties of N-ethenoxy-1,1-diphenylmethanimine?
N-ethenoxy-1,1-diphenylmethanimine has a molecular weight of 223.27 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenoxy-1,1-diphenylmethanimine is sourced from PubChem (CID 12982594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).