2-(1-methylimidazol-2-yl)-1,1-diphenylethanol

C18H18N2O — CID 771820

IUPAC2-(1-methylimidazol-2-yl)-1,1-diphenylethanol
SMILESCn1ccnc1CC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H18N2O/c1-20-13-12-19-17(20)14-18(21,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,21H,14H2,1H3
InChIKeyJEBPYPNETYWCJE-UHFFFAOYSA-N
MW278.36 g/mol
LogP2.90
Rot. Bonds4

About 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol

2-(1-methylimidazol-2-yl)-1,1-diphenylethanol (PubChem CID 771820) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol.

Molecular Properties

Compound Name2-(1-methylimidazol-2-yl)-1,1-diphenylethanol
PubChem CID771820
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-(1-methylimidazol-2-yl)-1,1-diphenylethanol
SMILESCn1ccnc1CC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H18N2O/c1-20-13-12-19-17(20)14-18(21,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,21H,14H2,1H3
InChIKeyJEBPYPNETYWCJE-UHFFFAOYSA-N
XLogP2.90
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 ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol?
The IUPAC name of 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol (CID 771820) is 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol.
What is the SMILES notation for 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol?
The canonical SMILES for 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol is Cn1ccnc1CC(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol?
The InChIKey is JEBPYPNETYWCJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-20-13-12-19-17(20)14-18(21,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,21H,14H2,1H3.
What are the key properties of 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol?
2-(1-methylimidazol-2-yl)-1,1-diphenylethanol has a molecular weight of 278.36 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazol-2-yl)-1,1-diphenylethanol is sourced from PubChem (CID 771820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).