N,4,6-triphenylpyran-2-imine

C23H17NO — CID 3692712

IUPACN,4,6-triphenylpyran-2-imine
SMILESc1ccc(/N=c2\cc(-c3ccccc3)cc(-c3ccccc3)o2)cc1
InChIInChI=1S/C23H17NO/c1-4-10-18(11-5-1)20-16-22(19-12-6-2-7-13-19)25-23(17-20)24-21-14-8-3-9-15-21/h1-17H/b24-23+
InChIKeyRNWKRKZIIDMAAF-WCWDXBQESA-N
MW323.40 g/mol
LogP5.85
Rot. Bonds3

About N,4,6-triphenylpyran-2-imine

N,4,6-triphenylpyran-2-imine (PubChem CID 3692712) has the molecular formula C23H17NO and a molecular weight of 323.40 g/mol. Its IUPAC name is N,4,6-triphenylpyran-2-imine.

Molecular Properties

Compound NameN,4,6-triphenylpyran-2-imine
PubChem CID3692712
Molecular FormulaC23H17NO
Molecular Weight323.40 g/mol
Exact Mass323.13
IUPAC NameN,4,6-triphenylpyran-2-imine
SMILESc1ccc(/N=c2\cc(-c3ccccc3)cc(-c3ccccc3)o2)cc1
InChIInChI=1S/C23H17NO/c1-4-10-18(11-5-1)20-16-22(19-12-6-2-7-13-19)25-23(17-20)24-21-14-8-3-9-15-21/h1-17H/b24-23+
InChIKeyRNWKRKZIIDMAAF-WCWDXBQESA-N
XLogP5.85
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.40
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,4,6-triphenylpyran-2-imine?
The IUPAC name of N,4,6-triphenylpyran-2-imine (CID 3692712) is N,4,6-triphenylpyran-2-imine.
What is the SMILES notation for N,4,6-triphenylpyran-2-imine?
The canonical SMILES for N,4,6-triphenylpyran-2-imine is c1ccc(/N=c2\cc(-c3ccccc3)cc(-c3ccccc3)o2)cc1.
What is the InChIKey of N,4,6-triphenylpyran-2-imine?
The InChIKey is RNWKRKZIIDMAAF-WCWDXBQESA-N. The full InChI is InChI=1S/C23H17NO/c1-4-10-18(11-5-1)20-16-22(19-12-6-2-7-13-19)25-23(17-20)24-21-14-8-3-9-15-21/h1-17H/b24-23+.
What are the key properties of N,4,6-triphenylpyran-2-imine?
N,4,6-triphenylpyran-2-imine has a molecular weight of 323.40 g/mol, XLogP of 5.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,6-triphenylpyran-2-imine is sourced from PubChem (CID 3692712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).