2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol

C18H18N2O — CID 56740009

IUPAC2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol
SMILESCc1ccccc1-c1cccc(-c2nccn2CCO)c1
InChIInChI=1S/C18H18N2O/c1-14-5-2-3-8-17(14)15-6-4-7-16(13-15)18-19-9-10-20(18)11-12-21/h2-10,13,21H,11-12H2,1H3
InChIKeyGCWOPWVMKIATBR-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.52
Rot. Bonds4

About 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol

2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol (PubChem CID 56740009) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol
PubChem CID56740009
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol
SMILESCc1ccccc1-c1cccc(-c2nccn2CCO)c1
InChIInChI=1S/C18H18N2O/c1-14-5-2-3-8-17(14)15-6-4-7-16(13-15)18-19-9-10-20(18)11-12-21/h2-10,13,21H,11-12H2,1H3
InChIKeyGCWOPWVMKIATBR-UHFFFAOYSA-N
XLogP3.52
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol?
The IUPAC name of 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol (CID 56740009) is 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol.
What is the SMILES notation for 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol?
The canonical SMILES for 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol is Cc1ccccc1-c1cccc(-c2nccn2CCO)c1.
What is the InChIKey of 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol?
The InChIKey is GCWOPWVMKIATBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-14-5-2-3-8-17(14)15-6-4-7-16(13-15)18-19-9-10-20(18)11-12-21/h2-10,13,21H,11-12H2,1H3.
What are the key properties of 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol?
2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol has a molecular weight of 278.36 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(2-methylphenyl)phenyl]imidazol-1-yl]ethanol is sourced from PubChem (CID 56740009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).