2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide

C28H25NO2 — CID 16663785

IUPAC2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide
SMILESO=C(NCCc1ccccc1)c1cc(OCc2ccccc2)ccc1-c1ccccc1
InChIInChI=1S/C28H25NO2/c30-28(29-19-18-22-10-4-1-5-11-22)27-20-25(31-21-23-12-6-2-7-13-23)16-17-26(27)24-14-8-3-9-15-24/h1-17,20H,18-19,21H2,(H,29,30)
InChIKeyWACISJMFGHUSJS-UHFFFAOYSA-N
MW407.51 g/mol
LogP5.91
Rot. Bonds8

About 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide

2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide (PubChem CID 16663785) has the molecular formula C28H25NO2 and a molecular weight of 407.51 g/mol. Its IUPAC name is 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide.

Molecular Properties

Compound Name2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide
PubChem CID16663785
Molecular FormulaC28H25NO2
Molecular Weight407.51 g/mol
Exact Mass407.19
IUPAC Name2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide
SMILESO=C(NCCc1ccccc1)c1cc(OCc2ccccc2)ccc1-c1ccccc1
InChIInChI=1S/C28H25NO2/c30-28(29-19-18-22-10-4-1-5-11-22)27-20-25(31-21-23-12-6-2-7-13-23)16-17-26(27)24-14-8-3-9-15-24/h1-17,20H,18-19,21H2,(H,29,30)
InChIKeyWACISJMFGHUSJS-UHFFFAOYSA-N
XLogP5.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.51
LogP ≤ 55.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide?
The IUPAC name of 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide (CID 16663785) is 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide.
What is the SMILES notation for 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide?
The canonical SMILES for 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide is O=C(NCCc1ccccc1)c1cc(OCc2ccccc2)ccc1-c1ccccc1.
What is the InChIKey of 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide?
The InChIKey is WACISJMFGHUSJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25NO2/c30-28(29-19-18-22-10-4-1-5-11-22)27-20-25(31-21-23-12-6-2-7-13-23)16-17-26(27)24-14-8-3-9-15-24/h1-17,20H,18-19,21H2,(H,29,30).
What are the key properties of 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide?
2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide has a molecular weight of 407.51 g/mol, XLogP of 5.91, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide is sourced from PubChem (CID 16663785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).