(1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol

C16H16N2O — CID 51517940

IUPAC(1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol
SMILESCc1nc2ccccc2n1C[C@H](O)c1ccccc1
InChIInChI=1S/C16H16N2O/c1-12-17-14-9-5-6-10-15(14)18(12)11-16(19)13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3/t16-/m0/s1
InChIKeyAXXDMHANFAYSEO-INIZCTEOSA-N
MW252.32 g/mol
LogP3.08
Rot. Bonds3

About (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol

(1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol (PubChem CID 51517940) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol.

Molecular Properties

Compound Name(1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol
PubChem CID51517940
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name(1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol
SMILESCc1nc2ccccc2n1C[C@H](O)c1ccccc1
InChIInChI=1S/C16H16N2O/c1-12-17-14-9-5-6-10-15(14)18(12)11-16(19)13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3/t16-/m0/s1
InChIKeyAXXDMHANFAYSEO-INIZCTEOSA-N
XLogP3.08
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(aminomethyl)phenyl]-2-(2-methylbenzimidazol-1-yl)ethanol
CID 43531451
2-(2-methylbenzimidazol-1-yl)ethane-1,1-diol
CID 134100901
3-(2-methylbenzimidazol-1-yl)-1-phenylpropan-1-ol
CID 3689671
2-(2-methylsulfanylbenzimidazol-1-yl)-1-phenylethanol
CID 4918049
2-[2-(hydroxymethyl)benzimidazol-1-yl]-1-phenylethanol
CID 17479592
1-(2-chlorophenyl)-2-(2-methylbenzimidazol-1-yl)ethanol
CID 47276894
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-methylbenzimidazol-1-yl)ethanol
CID 47073519
N-[(1S)-1-[1-[(2S)-2-hydroxy-2-phenylethyl]benzimidazol-2-yl]ethyl]acetamide
CID 25486343
1-(2,2-dimethoxyethyl)-2-methylbenzimidazole
CID 66222131
(2S)-4-(2-methylbenzimidazol-1-yl)butan-2-ol
CID 139248448
(2R)-1-[4-[(2R)-2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]phenoxy]-3-(2-methylbenzimidazol-1-yl)propan-2-ol
CID 1151095
1-ethyl-3-[[1-(2-hydroxy-2-phenylethyl)benzimidazol-2-yl]methyl]benzimidazol-2-one
CID 11567786

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
The IUPAC name of (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol (CID 51517940) is (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol.
What is the SMILES notation for (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
The canonical SMILES for (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol is Cc1nc2ccccc2n1C[C@H](O)c1ccccc1.
What is the InChIKey of (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
The InChIKey is AXXDMHANFAYSEO-INIZCTEOSA-N. The full InChI is InChI=1S/C16H16N2O/c1-12-17-14-9-5-6-10-15(14)18(12)11-16(19)13-7-3-2-4-8-13/h2-10,16,19H,11H2,1H3/t16-/m0/s1.
What are the key properties of (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol?
(1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol has a molecular weight of 252.32 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(2-methylbenzimidazol-1-yl)-1-phenylethanol is sourced from PubChem (CID 51517940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).