4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide

C25H20N2O2 — CID 38670554

IUPAC4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
SMILESO=C(Nc1cccc(OCc2ccccn2)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C25H20N2O2/c28-25(21-14-12-20(13-15-21)19-7-2-1-3-8-19)27-22-10-6-11-24(17-22)29-18-23-9-4-5-16-26-23/h1-17H,18H2,(H,27,28)
InChIKeyWZQQAPLKZBMZSK-UHFFFAOYSA-N
MW380.45 g/mol
LogP5.58
Rot. Bonds6

About 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide

4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide (PubChem CID 38670554) has the molecular formula C25H20N2O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
PubChem CID38670554
Molecular FormulaC25H20N2O2
Molecular Weight380.45 g/mol
Exact Mass380.15
IUPAC Name4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
SMILESO=C(Nc1cccc(OCc2ccccn2)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C25H20N2O2/c28-25(21-14-12-20(13-15-21)19-7-2-1-3-8-19)27-22-10-6-11-24(17-22)29-18-23-9-4-5-16-26-23/h1-17H,18H2,(H,27,28)
InChIKeyWZQQAPLKZBMZSK-UHFFFAOYSA-N
XLogP5.58
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.45
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide?
The IUPAC name of 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide (CID 38670554) is 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide.
What is the SMILES notation for 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide?
The canonical SMILES for 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide is O=C(Nc1cccc(OCc2ccccn2)c1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide?
The InChIKey is WZQQAPLKZBMZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O2/c28-25(21-14-12-20(13-15-21)19-7-2-1-3-8-19)27-22-10-6-11-24(17-22)29-18-23-9-4-5-16-26-23/h1-17H,18H2,(H,27,28).
What are the key properties of 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide?
4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide has a molecular weight of 380.45 g/mol, XLogP of 5.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide is sourced from PubChem (CID 38670554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).