N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide

C26H27N3O2 — CID 17032294

IUPACN-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(COc2ccc3ccccc3c2)nc2ccccc21)NC1CCCCC1
InChIInChI=1S/C26H27N3O2/c30-26(27-21-10-2-1-3-11-21)17-29-24-13-7-6-12-23(24)28-25(29)18-31-22-15-14-19-8-4-5-9-20(19)16-22/h4-9,12-16,21H,1-3,10-11,17-18H2,(H,27,30)
InChIKeyFAPKWPMCSUAQMJ-UHFFFAOYSA-N
MW413.52 g/mol
LogP5.22
Rot. Bonds6

About N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide

N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide (PubChem CID 17032294) has the molecular formula C26H27N3O2 and a molecular weight of 413.52 g/mol. Its IUPAC name is N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
PubChem CID17032294
Molecular FormulaC26H27N3O2
Molecular Weight413.52 g/mol
Exact Mass413.21
IUPAC NameN-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(COc2ccc3ccccc3c2)nc2ccccc21)NC1CCCCC1
InChIInChI=1S/C26H27N3O2/c30-26(27-21-10-2-1-3-11-21)17-29-24-13-7-6-12-23(24)28-25(29)18-31-22-15-14-19-8-4-5-9-20(19)16-22/h4-9,12-16,21H,1-3,10-11,17-18H2,(H,27,30)
InChIKeyFAPKWPMCSUAQMJ-UHFFFAOYSA-N
XLogP5.22
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.52
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(azepan-1-yl)-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]ethanone
CID 16999317
N-cyclohexyl-2-(2-propylbenzimidazol-1-yl)acetamide
CID 17028657
1-(2-methylpiperidin-1-yl)-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]ethanone
CID 16999320
N-cyclooctyl-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide
CID 34366434
N-(3-methylphenyl)-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
CID 17032304
2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]-N-[(2R)-4-phenylbutan-2-yl]acetamide
CID 32735745
N,N-bis(2-methylpropyl)-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
CID 16999311
N-cyclopentyl-2-[2-(2-phenylethenyl)benzimidazol-1-yl]acetamide
CID 71899062
N,N-dicyclohexyl-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 16997064
N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
CID 16999316
N-[2-[1-[2-(cyclohexylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]-2-methylbenzamide
CID 17030705
2-[2-(2-amino-2-oxoethyl)sulfanylbenzimidazol-1-yl]-N-cyclohexylacetamide
CID 3224652

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide (CID 17032294) is N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide is O=C(Cn1c(COc2ccc3ccccc3c2)nc2ccccc21)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
The InChIKey is FAPKWPMCSUAQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O2/c30-26(27-21-10-2-1-3-11-21)17-29-24-13-7-6-12-23(24)28-25(29)18-31-22-15-14-19-8-4-5-9-20(19)16-22/h4-9,12-16,21H,1-3,10-11,17-18H2,(H,27,30).
What are the key properties of N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide has a molecular weight of 413.52 g/mol, XLogP of 5.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 17032294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).