N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide

C26H21NO2 — CID 10762274

IUPACN-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide
SMILESO=C(NCc1ccccc1)c1ccc(-c2cc(O)cc(-c3ccccc3)c2)cc1
InChIInChI=1S/C26H21NO2/c28-25-16-23(20-9-5-2-6-10-20)15-24(17-25)21-11-13-22(14-12-21)26(29)27-18-19-7-3-1-4-8-19/h1-17,28H,18H2,(H,27,29)
InChIKeyHHCKRYHQVYEFMJ-UHFFFAOYSA-N
MW379.46 g/mol
LogP5.66
Rot. Bonds5

About N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide

N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide (PubChem CID 10762274) has the molecular formula C26H21NO2 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide.

Molecular Properties

Compound NameN-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide
PubChem CID10762274
Molecular FormulaC26H21NO2
Molecular Weight379.46 g/mol
Exact Mass379.16
IUPAC NameN-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide
SMILESO=C(NCc1ccccc1)c1ccc(-c2cc(O)cc(-c3ccccc3)c2)cc1
InChIInChI=1S/C26H21NO2/c28-25-16-23(20-9-5-2-6-10-20)15-24(17-25)21-11-13-22(14-12-21)26(29)27-18-19-7-3-1-4-8-19/h1-17,28H,18H2,(H,27,29)
InChIKeyHHCKRYHQVYEFMJ-UHFFFAOYSA-N
XLogP5.66
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.46
LogP ≤ 55.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide?
The IUPAC name of N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide (CID 10762274) is N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide.
What is the SMILES notation for N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide?
The canonical SMILES for N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide is O=C(NCc1ccccc1)c1ccc(-c2cc(O)cc(-c3ccccc3)c2)cc1.
What is the InChIKey of N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide?
The InChIKey is HHCKRYHQVYEFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21NO2/c28-25-16-23(20-9-5-2-6-10-20)15-24(17-25)21-11-13-22(14-12-21)26(29)27-18-19-7-3-1-4-8-19/h1-17,28H,18H2,(H,27,29).
What are the key properties of N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide?
N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide has a molecular weight of 379.46 g/mol, XLogP of 5.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(3-hydroxy-5-phenylphenyl)benzamide is sourced from PubChem (CID 10762274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).