1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol

C20H22N2O — CID 142479432

IUPAC1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol
SMILESCC(O)c1nccn1CCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H22N2O/c1-16(23)20-21-13-15-22(20)14-5-6-17-9-11-19(12-10-17)18-7-3-2-4-8-18/h2-4,7-13,15-16,23H,5-6,14H2,1H3
InChIKeyWBKYXOOBKLUJFE-UHFFFAOYSA-N
MW306.41 g/mol
LogP4.24
Rot. Bonds6

About 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol

1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol (PubChem CID 142479432) has the molecular formula C20H22N2O and a molecular weight of 306.41 g/mol. Its IUPAC name is 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol
PubChem CID142479432
Molecular FormulaC20H22N2O
Molecular Weight306.41 g/mol
Exact Mass306.17
IUPAC Name1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol
SMILESCC(O)c1nccn1CCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H22N2O/c1-16(23)20-21-13-15-22(20)14-5-6-17-9-11-19(12-10-17)18-7-3-2-4-8-18/h2-4,7-13,15-16,23H,5-6,14H2,1H3
InChIKeyWBKYXOOBKLUJFE-UHFFFAOYSA-N
XLogP4.24
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol?
The IUPAC name of 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol (CID 142479432) is 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol.
What is the SMILES notation for 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol?
The canonical SMILES for 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol is CC(O)c1nccn1CCCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol?
The InChIKey is WBKYXOOBKLUJFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O/c1-16(23)20-21-13-15-22(20)14-5-6-17-9-11-19(12-10-17)18-7-3-2-4-8-18/h2-4,7-13,15-16,23H,5-6,14H2,1H3.
What are the key properties of 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol?
1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol has a molecular weight of 306.41 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[3-(4-phenylphenyl)propyl]imidazol-2-yl]ethanol is sourced from PubChem (CID 142479432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).