(1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol

C22H20N2O2 — CID 67152123

IUPAC(1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol
SMILESCOc1ccccc1-c1cccc(-n2cnc3cc([C@@H](C)O)ccc32)c1
InChIInChI=1S/C22H20N2O2/c1-15(25)16-10-11-21-20(13-16)23-14-24(21)18-7-5-6-17(12-18)19-8-3-4-9-22(19)26-2/h3-15,25H,1-2H3/t15-/m1/s1
InChIKeyGDBZOUCIDXIKON-OAHLLOKOSA-N
MW344.41 g/mol
LogP4.75
Rot. Bonds4

About (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol

(1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol (PubChem CID 67152123) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol
PubChem CID67152123
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name(1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol
SMILESCOc1ccccc1-c1cccc(-n2cnc3cc([C@@H](C)O)ccc32)c1
InChIInChI=1S/C22H20N2O2/c1-15(25)16-10-11-21-20(13-16)23-14-24(21)18-7-5-6-17(12-18)19-8-3-4-9-22(19)26-2/h3-15,25H,1-2H3/t15-/m1/s1
InChIKeyGDBZOUCIDXIKON-OAHLLOKOSA-N
XLogP4.75
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol?
The IUPAC name of (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol (CID 67152123) is (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol.
What is the SMILES notation for (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol?
The canonical SMILES for (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol is COc1ccccc1-c1cccc(-n2cnc3cc([C@@H](C)O)ccc32)c1.
What is the InChIKey of (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol?
The InChIKey is GDBZOUCIDXIKON-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-15(25)16-10-11-21-20(13-16)23-14-24(21)18-7-5-6-17(12-18)19-8-3-4-9-22(19)26-2/h3-15,25H,1-2H3/t15-/m1/s1.
What are the key properties of (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol?
(1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol has a molecular weight of 344.41 g/mol, XLogP of 4.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-[3-(2-methoxyphenyl)phenyl]benzimidazol-5-yl]ethanol is sourced from PubChem (CID 67152123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).