4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol

C24H21N3O2 — CID 129137244

IUPAC4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol
SMILESNc1ccc(C(Cn2ccnc2)=C(c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C24H21N3O2/c25-20-7-1-17(2-8-20)23(15-27-14-13-26-16-27)24(18-3-9-21(28)10-4-18)19-5-11-22(29)12-6-19/h1-14,16,28-29H,15,25H2
InChIKeyIFRHFQXUAFBJFL-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.54
Rot. Bonds5

About 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol

4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol (PubChem CID 129137244) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol.

Molecular Properties

Compound Name4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol
PubChem CID129137244
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol
SMILESNc1ccc(C(Cn2ccnc2)=C(c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C24H21N3O2/c25-20-7-1-17(2-8-20)23(15-27-14-13-26-16-27)24(18-3-9-21(28)10-4-18)19-5-11-22(29)12-6-19/h1-14,16,28-29H,15,25H2
InChIKeyIFRHFQXUAFBJFL-UHFFFAOYSA-N
XLogP4.54
TPSA84.30 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol?
The IUPAC name of 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol (CID 129137244) is 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol.
What is the SMILES notation for 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol?
The canonical SMILES for 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol is Nc1ccc(C(Cn2ccnc2)=C(c2ccc(O)cc2)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol?
The InChIKey is IFRHFQXUAFBJFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2/c25-20-7-1-17(2-8-20)23(15-27-14-13-26-16-27)24(18-3-9-21(28)10-4-18)19-5-11-22(29)12-6-19/h1-14,16,28-29H,15,25H2.
What are the key properties of 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol?
4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol has a molecular weight of 383.45 g/mol, XLogP of 4.54, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-aminophenyl)-1-(4-hydroxyphenyl)-3-imidazol-1-ylprop-1-enyl]phenol is sourced from PubChem (CID 129137244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).