(Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine

C18H14N2O — CID 134940290

IUPAC(Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine
SMILESc1ccc(O/N=C(/c2ccccc2)c2cccnc2)cc1
InChIInChI=1S/C18H14N2O/c1-3-8-15(9-4-1)18(16-10-7-13-19-14-16)20-21-17-11-5-2-6-12-17/h1-14H/b20-18-
InChIKeyYBJRRSUSZVPKIV-ZZEZOPTASA-N
MW274.32 g/mol
LogP3.91
Rot. Bonds4

About (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine

(Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine (PubChem CID 134940290) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine.

Molecular Properties

Compound Name(Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine
PubChem CID134940290
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name(Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine
SMILESc1ccc(O/N=C(/c2ccccc2)c2cccnc2)cc1
InChIInChI=1S/C18H14N2O/c1-3-8-15(9-4-1)18(16-10-7-13-19-14-16)20-21-17-11-5-2-6-12-17/h1-14H/b20-18-
InChIKeyYBJRRSUSZVPKIV-ZZEZOPTASA-N
XLogP3.91
TPSA34.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine?
The IUPAC name of (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine (CID 134940290) is (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine.
What is the SMILES notation for (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine?
The canonical SMILES for (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine is c1ccc(O/N=C(/c2ccccc2)c2cccnc2)cc1.
What is the InChIKey of (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine?
The InChIKey is YBJRRSUSZVPKIV-ZZEZOPTASA-N. The full InChI is InChI=1S/C18H14N2O/c1-3-8-15(9-4-1)18(16-10-7-13-19-14-16)20-21-17-11-5-2-6-12-17/h1-14H/b20-18-.
What are the key properties of (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine?
(Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine has a molecular weight of 274.32 g/mol, XLogP of 3.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-phenoxy-1-phenyl-1-pyridin-3-ylmethanimine is sourced from PubChem (CID 134940290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).