2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol

C21H18N2O — CID 118619438

IUPAC2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol
SMILESOCCc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1
InChIInChI=1S/C21H18N2O/c24-15-14-16-10-12-17(13-11-16)21-22-19-8-4-5-9-20(19)23(21)18-6-2-1-3-7-18/h1-13,24H,14-15H2
InChIKeyTVGFQWYGRAIEPB-UHFFFAOYSA-N
MW314.39 g/mol
LogP4.23
Rot. Bonds4

About 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol

2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol (PubChem CID 118619438) has the molecular formula C21H18N2O and a molecular weight of 314.39 g/mol. Its IUPAC name is 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol.

Molecular Properties

Compound Name2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol
PubChem CID118619438
Molecular FormulaC21H18N2O
Molecular Weight314.39 g/mol
Exact Mass314.14
IUPAC Name2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol
SMILESOCCc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1
InChIInChI=1S/C21H18N2O/c24-15-14-16-10-12-17(13-11-16)21-22-19-8-4-5-9-20(19)23(21)18-6-2-1-3-7-18/h1-13,24H,14-15H2
InChIKeyTVGFQWYGRAIEPB-UHFFFAOYSA-N
XLogP4.23
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzimidazole
CID 18629889
2-[4-[4,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 155186062
2-(4-bromophenyl)-1-phenylbenzimidazole
CID 23094070
1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)phenoxy]phenyl]benzimidazole
CID 141099436
1,2-diphenylbenzimidazole;ethane;iridium;propane
CID 142394497
1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
9-[4-[4-[4-[4-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58470934
2-[2,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole
CID 141061579
5,8-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]quinoxaline
CID 138705119
1-[4-[4,6-bis[4-(2-phenylbenzimidazol-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 152919581
2-[4-(1-methylnaphthalen-2-yl)phenyl]-1-phenylbenzimidazole
CID 135245229
3-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]quinazolin-4-one
CID 121247662

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol?
The IUPAC name of 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol (CID 118619438) is 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol.
What is the SMILES notation for 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol?
The canonical SMILES for 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol is OCCc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1.
What is the InChIKey of 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol?
The InChIKey is TVGFQWYGRAIEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O/c24-15-14-16-10-12-17(13-11-16)21-22-19-8-4-5-9-20(19)23(21)18-6-2-1-3-7-18/h1-13,24H,14-15H2.
What are the key properties of 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol?
2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol has a molecular weight of 314.39 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-phenylbenzimidazol-2-yl)phenyl]ethanol is sourced from PubChem (CID 118619438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).