[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol

C23H22N2O3 — CID 16995122

IUPAC[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol
SMILESCOc1ccccc1OCCn1c(C(O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C23H22N2O3/c1-27-20-13-7-8-14-21(20)28-16-15-25-19-12-6-5-11-18(19)24-23(25)22(26)17-9-3-2-4-10-17/h2-14,22,26H,15-16H2,1H3
InChIKeyDXFFZSQQLSNJMC-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.21
Rot. Bonds7

About [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol

[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol (PubChem CID 16995122) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol.

Molecular Properties

Compound Name[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol
PubChem CID16995122
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol
SMILESCOc1ccccc1OCCn1c(C(O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C23H22N2O3/c1-27-20-13-7-8-14-21(20)28-16-15-25-19-12-6-5-11-18(19)24-23(25)22(26)17-9-3-2-4-10-17/h2-14,22,26H,15-16H2,1H3
InChIKeyDXFFZSQQLSNJMC-UHFFFAOYSA-N
XLogP4.21
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(R)-[1-(2-methoxyethyl)benzimidazol-2-yl]-phenylmethanol
CID 40699008
[1-[2-(3-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol
CID 16995132
(S)-[1-(2-ethoxyethyl)benzimidazol-2-yl]-phenylmethanol
CID 6998450
phenyl-[1-[4-(2-propan-2-ylphenoxy)butyl]benzimidazol-2-yl]methanol
CID 16995165
[1-[3-(2-chlorophenoxy)propyl]benzimidazol-2-yl]-phenylmethanol
CID 4898002
[1-[4-(2,3-dimethylphenoxy)butyl]benzimidazol-2-yl]-phenylmethanol
CID 16995160
1-[4-(2-methoxyphenoxy)butyl]-2-propan-2-ylbenzimidazole
CID 16996559
2-[(1S)-1-(azepan-1-yl)ethyl]-1-[2-(2-methoxyphenoxy)ethyl]benzimidazole
CID 96571436
1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-amine
CID 2984464
(2-methoxyphenyl)-(1-propylbenzimidazol-2-yl)methanol
CID 3786297
[1-[4-(3,5-dimethylphenoxy)butyl]benzimidazol-2-yl]-phenylmethanol
CID 16995174
[1-[4-(3,4-dimethylphenoxy)butyl]benzimidazol-2-yl]-phenylmethanol
CID 16995172

Frequently Asked Questions

What is the IUPAC name of [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol?
The IUPAC name of [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol (CID 16995122) is [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol.
What is the SMILES notation for [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol?
The canonical SMILES for [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol is COc1ccccc1OCCn1c(C(O)c2ccccc2)nc2ccccc21.
What is the InChIKey of [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol?
The InChIKey is DXFFZSQQLSNJMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-27-20-13-7-8-14-21(20)28-16-15-25-19-12-6-5-11-18(19)24-23(25)22(26)17-9-3-2-4-10-17/h2-14,22,26H,15-16H2,1H3.
What are the key properties of [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol?
[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol has a molecular weight of 374.44 g/mol, XLogP of 4.21, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]-phenylmethanol is sourced from PubChem (CID 16995122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).