N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide

C30H25N3O — CID 70261482

IUPACN-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide
SMILESO=C(Nc1nc(-c2ccccc2)cn1-c1ccccc1)c1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C30H25N3O/c34-29(26-20-18-24(19-21-26)17-16-23-10-4-1-5-11-23)32-30-31-28(25-12-6-2-7-13-25)22-33(30)27-14-8-3-9-15-27/h1-15,18-22H,16-17H2,(H,31,32,34)
InChIKeyVGCKFRZHLZSEMM-UHFFFAOYSA-N
MW443.55 g/mol
LogP6.58
Rot. Bonds7

About N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide

N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide (PubChem CID 70261482) has the molecular formula C30H25N3O and a molecular weight of 443.55 g/mol. Its IUPAC name is N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide.

Molecular Properties

Compound NameN-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide
PubChem CID70261482
Molecular FormulaC30H25N3O
Molecular Weight443.55 g/mol
Exact Mass443.20
IUPAC NameN-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide
SMILESO=C(Nc1nc(-c2ccccc2)cn1-c1ccccc1)c1ccc(CCc2ccccc2)cc1
InChIInChI=1S/C30H25N3O/c34-29(26-20-18-24(19-21-26)17-16-23-10-4-1-5-11-23)32-30-31-28(25-12-6-2-7-13-25)22-33(30)27-14-8-3-9-15-27/h1-15,18-22H,16-17H2,(H,31,32,34)
InChIKeyVGCKFRZHLZSEMM-UHFFFAOYSA-N
XLogP6.58
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.55
LogP ≤ 56.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide?
The IUPAC name of N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide (CID 70261482) is N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide.
What is the SMILES notation for N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide?
The canonical SMILES for N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide is O=C(Nc1nc(-c2ccccc2)cn1-c1ccccc1)c1ccc(CCc2ccccc2)cc1.
What is the InChIKey of N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide?
The InChIKey is VGCKFRZHLZSEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25N3O/c34-29(26-20-18-24(19-21-26)17-16-23-10-4-1-5-11-23)32-30-31-28(25-12-6-2-7-13-25)22-33(30)27-14-8-3-9-15-27/h1-15,18-22H,16-17H2,(H,31,32,34).
What are the key properties of N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide?
N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide has a molecular weight of 443.55 g/mol, XLogP of 6.58, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-diphenylimidazol-2-yl)-4-(2-phenylethyl)benzamide is sourced from PubChem (CID 70261482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).