2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol

C22H22N2O2 — CID 19242287

IUPAC2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol
SMILESCC(C)(O)c1nc2ccccc2n1CCOc1cccc2ccccc12
InChIInChI=1S/C22H22N2O2/c1-22(2,25)21-23-18-11-5-6-12-19(18)24(21)14-15-26-20-13-7-9-16-8-3-4-10-17(16)20/h3-13,25H,14-15H2,1-2H3
InChIKeyHOLWXSFINNNIAJ-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.50
Rot. Bonds5

About 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol

2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol (PubChem CID 19242287) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol
PubChem CID19242287
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol
SMILESCC(C)(O)c1nc2ccccc2n1CCOc1cccc2ccccc12
InChIInChI=1S/C22H22N2O2/c1-22(2,25)21-23-18-11-5-6-12-19(18)24(21)14-15-26-20-13-7-9-16-8-3-4-10-17(16)20/h3-13,25H,14-15H2,1-2H3
InChIKeyHOLWXSFINNNIAJ-UHFFFAOYSA-N
XLogP4.50
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(3-naphthalen-1-yloxypropyl)benzimidazol-2-yl]propan-2-ol
CID 19242286
2-[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]propan-2-ol
CID 17027789
2-[1-[2-(2-chlorophenoxy)ethyl]benzimidazol-2-yl]propan-2-ol
CID 19242241
2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethanol
CID 19242359
2,2-dimethyl-N-[2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethyl]propanamide
CID 6490606
2-[1-[3-(2,5-dimethylphenoxy)propyl]benzimidazol-2-yl]propan-2-ol
CID 19242272
N-[[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]methyl]acetamide
CID 17005950
2,2-dimethyl-N-[3-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propyl]propanamide
CID 16981462
1-[1-(3-naphthalen-1-yloxypropyl)benzimidazol-2-yl]ethanol
CID 3160724
2-methoxy-N-[1-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethyl]acetamide
CID 16969225
N-[1-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethyl]propanamide
CID 16968622
N-[1-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]ethyl]-2-phenoxyacetamide
CID 16971779

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol?
The IUPAC name of 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol (CID 19242287) is 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol.
What is the SMILES notation for 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol?
The canonical SMILES for 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol is CC(C)(O)c1nc2ccccc2n1CCOc1cccc2ccccc12.
What is the InChIKey of 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol?
The InChIKey is HOLWXSFINNNIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-22(2,25)21-23-18-11-5-6-12-19(18)24(21)14-15-26-20-13-7-9-16-8-3-4-10-17(16)20/h3-13,25H,14-15H2,1-2H3.
What are the key properties of 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol?
2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol has a molecular weight of 346.43 g/mol, XLogP of 4.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]propan-2-ol is sourced from PubChem (CID 19242287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).