2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol

C29H25N3O — CID 20577222

IUPAC2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol
SMILESNc1cccc(-c2ccccc2-c2nc(-c3ccccc3)c(-c3ccccc3)n2CCO)c1
InChIInChI=1S/C29H25N3O/c30-24-15-9-14-23(20-24)25-16-7-8-17-26(25)29-31-27(21-10-3-1-4-11-21)28(32(29)18-19-33)22-12-5-2-6-13-22/h1-17,20,33H,18-19,30H2
InChIKeySDQAZZZWHWOPHH-UHFFFAOYSA-N
MW431.54 g/mol
LogP6.13
Rot. Bonds6

About 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol

2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol (PubChem CID 20577222) has the molecular formula C29H25N3O and a molecular weight of 431.54 g/mol. Its IUPAC name is 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol
PubChem CID20577222
Molecular FormulaC29H25N3O
Molecular Weight431.54 g/mol
Exact Mass431.20
IUPAC Name2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol
SMILESNc1cccc(-c2ccccc2-c2nc(-c3ccccc3)c(-c3ccccc3)n2CCO)c1
InChIInChI=1S/C29H25N3O/c30-24-15-9-14-23(20-24)25-16-7-8-17-26(25)29-31-27(21-10-3-1-4-11-21)28(32(29)18-19-33)22-12-5-2-6-13-22/h1-17,20,33H,18-19,30H2
InChIKeySDQAZZZWHWOPHH-UHFFFAOYSA-N
XLogP6.13
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.54
LogP ≤ 56.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-[2-(4,5-diphenyl-1-propylimidazol-2-yl)phenyl]aniline
CID 20577315
2-[2-(2,4-dimethoxyphenyl)-4,5-diphenylimidazol-1-yl]ethanol
CID 122385213
3-[2-(2-phenylphenyl)phenyl]aniline
CID 172502206
2-[3-[2-[1-(2-fluoroethyl)-4,5-diphenylimidazol-2-yl]phenyl]phenoxy]acetic acid
CID 20577249
3-[2-[2-(3-aminophenyl)phenyl]phenyl]aniline
CID 18003218
2-[2-(2-bromophenyl)-4,5-diphenylimidazol-1-yl]ethyl acetate
CID 20821454
2-[1-(3-aminophenyl)-[1,2,4]triazolo[3,4-b]benzimidazol-4-yl]ethanol
CID 82590380
2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole
CID 20577238
2-[2-(5-amino-2-methylphenyl)benzimidazol-1-yl]ethanol
CID 63652268
2-[2-(2-bromophenyl)-4,5-diphenylimidazol-1-yl]acetic acid;2-[3-[2-[1-(carboxymethyl)-4,5-diphenylimidazol-2-yl]phenyl]anilino]acetic acid;methane
CID 159380134
2-[2-(2-amino-3-bromophenyl)benzimidazol-1-yl]ethanol
CID 63112894
7-(2,4,5-triphenylimidazol-1-yl)heptanoic acid
CID 22916430

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol?
The IUPAC name of 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol (CID 20577222) is 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol.
What is the SMILES notation for 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol?
The canonical SMILES for 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol is Nc1cccc(-c2ccccc2-c2nc(-c3ccccc3)c(-c3ccccc3)n2CCO)c1.
What is the InChIKey of 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol?
The InChIKey is SDQAZZZWHWOPHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H25N3O/c30-24-15-9-14-23(20-24)25-16-7-8-17-26(25)29-31-27(21-10-3-1-4-11-21)28(32(29)18-19-33)22-12-5-2-6-13-22/h1-17,20,33H,18-19,30H2.
What are the key properties of 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol?
2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol has a molecular weight of 431.54 g/mol, XLogP of 6.13, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol is sourced from PubChem (CID 20577222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).