N,1-diphenylethanimine

C14H13N — CID 555698

IUPACN,1-diphenylethanimine
SMILESC/C(=N\c1ccccc1)c1ccccc1
InChIInChI=1S/C14H13N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2-11H,1H3/b15-12+
InChIKeyCBXWICRJSHEQJT-NTCAYCPXSA-N
MW195.27 g/mol
LogP3.83
Rot. Bonds2

About N,1-diphenylethanimine

N,1-diphenylethanimine (PubChem CID 555698) has the molecular formula C14H13N and a molecular weight of 195.27 g/mol. Its IUPAC name is N,1-diphenylethanimine.

Molecular Properties

Compound NameN,1-diphenylethanimine
PubChem CID555698
Molecular FormulaC14H13N
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC NameN,1-diphenylethanimine
SMILESC/C(=N\c1ccccc1)c1ccccc1
InChIInChI=1S/C14H13N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2-11H,1H3/b15-12+
InChIKeyCBXWICRJSHEQJT-NTCAYCPXSA-N
XLogP3.83
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 N,1-diphenylethanimine?
The IUPAC name of N,1-diphenylethanimine (CID 555698) is N,1-diphenylethanimine.
What is the SMILES notation for N,1-diphenylethanimine?
The canonical SMILES for N,1-diphenylethanimine is C/C(=N\c1ccccc1)c1ccccc1.
What is the InChIKey of N,1-diphenylethanimine?
The InChIKey is CBXWICRJSHEQJT-NTCAYCPXSA-N. The full InChI is InChI=1S/C14H13N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2-11H,1H3/b15-12+.
What are the key properties of N,1-diphenylethanimine?
N,1-diphenylethanimine has a molecular weight of 195.27 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-diphenylethanimine is sourced from PubChem (CID 555698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).