1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol

C23H24N2O2 — CID 15998647

IUPAC1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SMILESCC(C)c1nc2ccccc2n1CC(O)COc1ccc2ccccc2c1
InChIInChI=1S/C23H24N2O2/c1-16(2)23-24-21-9-5-6-10-22(21)25(23)14-19(26)15-27-20-12-11-17-7-3-4-8-18(17)13-20/h3-13,16,19,26H,14-15H2,1-2H3
InChIKeyUOIDHVHHSIHSSZ-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.75
Rot. Bonds6

About 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol

1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol (PubChem CID 15998647) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
PubChem CID15998647
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC Name1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
SMILESCC(C)c1nc2ccccc2n1CC(O)COc1ccc2ccccc2c1
InChIInChI=1S/C23H24N2O2/c1-16(2)23-24-21-9-5-6-10-22(21)25(23)14-19(26)15-27-20-12-11-17-7-3-4-8-18(17)13-20/h3-13,16,19,26H,14-15H2,1-2H3
InChIKeyUOIDHVHHSIHSSZ-UHFFFAOYSA-N
XLogP4.75
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-(3,5-dimethylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
CID 96571408
1-(2-propan-2-ylbenzimidazol-1-yl)-3-(4-propylphenoxy)propan-2-ol
CID 138960942
(2S)-1-[2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol
CID 7425030
(2S)-1-[2-[(1R)-1-hydroxyethyl]benzimidazol-1-yl]-3-(3-methoxyphenoxy)propan-2-ol
CID 7425022
1-(2-methylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol;hydrochloride
CID 138960886
1-(2,5-dimethylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
CID 138960897
1-(2-chloro-4-methylphenoxy)-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol
CID 138960959
1-[2-[(2S)-2-hydroxy-3-(2-propan-2-ylbenzimidazol-1-yl)propoxy]phenyl]ethanone
CID 1090516
(2R)-1-[4-[(2R)-2-hydroxy-3-(2-methylbenzimidazol-1-yl)propoxy]phenoxy]-3-(2-methylbenzimidazol-1-yl)propan-2-ol
CID 1151095
1-naphthalen-2-yloxy-3-[2-(oxan-4-yl)benzimidazol-1-yl]propan-2-ol
CID 138960604
1-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]ethanol
CID 18879025
1-(2-propan-2-ylbenzimidazol-1-yl)-3-(2-prop-2-enylphenoxy)propan-2-ol
CID 44884546

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol?
The IUPAC name of 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol (CID 15998647) is 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol?
The canonical SMILES for 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol is CC(C)c1nc2ccccc2n1CC(O)COc1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol?
The InChIKey is UOIDHVHHSIHSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-16(2)23-24-21-9-5-6-10-22(21)25(23)14-19(26)15-27-20-12-11-17-7-3-4-8-18(17)13-20/h3-13,16,19,26H,14-15H2,1-2H3.
What are the key properties of 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol?
1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol has a molecular weight of 360.46 g/mol, XLogP of 4.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yloxy-3-(2-propan-2-ylbenzimidazol-1-yl)propan-2-ol is sourced from PubChem (CID 15998647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).