N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide

C25H23N3O — CID 10452448

IUPACN-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide
SMILESO=C(NC(Cc1ccccc1)c1ncc[nH]1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H23N3O/c29-25(23(20-12-6-2-7-13-20)21-14-8-3-9-15-21)28-22(24-26-16-17-27-24)18-19-10-4-1-5-11-19/h1-17,22-23H,18H2,(H,26,27)(H,28,29)
InChIKeyOXWGOFHIZVUDGE-UHFFFAOYSA-N
MW381.48 g/mol
LogP4.64
Rot. Bonds7

About N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide

N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide (PubChem CID 10452448) has the molecular formula C25H23N3O and a molecular weight of 381.48 g/mol. Its IUPAC name is N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide
PubChem CID10452448
Molecular FormulaC25H23N3O
Molecular Weight381.48 g/mol
Exact Mass381.18
IUPAC NameN-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide
SMILESO=C(NC(Cc1ccccc1)c1ncc[nH]1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H23N3O/c29-25(23(20-12-6-2-7-13-20)21-14-8-3-9-15-21)28-22(24-26-16-17-27-24)18-19-10-4-1-5-11-19/h1-17,22-23H,18H2,(H,26,27)(H,28,29)
InChIKeyOXWGOFHIZVUDGE-UHFFFAOYSA-N
XLogP4.64
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide?
The IUPAC name of N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide (CID 10452448) is N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide is O=C(NC(Cc1ccccc1)c1ncc[nH]1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide?
The InChIKey is OXWGOFHIZVUDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O/c29-25(23(20-12-6-2-7-13-20)21-14-8-3-9-15-21)28-22(24-26-16-17-27-24)18-19-10-4-1-5-11-19/h1-17,22-23H,18H2,(H,26,27)(H,28,29).
What are the key properties of N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide?
N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide has a molecular weight of 381.48 g/mol, XLogP of 4.64, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-imidazol-2-yl)-2-phenylethyl]-2,2-diphenylacetamide is sourced from PubChem (CID 10452448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).