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

C28H25N3O2 — CID 16999316

IUPACN-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
SMILESCN(Cc1ccccc1)C(=O)Cn1c(COc2ccc3ccccc3c2)nc2ccccc21
InChIInChI=1S/C28H25N3O2/c1-30(18-21-9-3-2-4-10-21)28(32)19-31-26-14-8-7-13-25(26)29-27(31)20-33-24-16-15-22-11-5-6-12-23(22)17-24/h2-17H,18-20H2,1H3
InChIKeyAOUCDZRMZSCVIZ-UHFFFAOYSA-N
MW435.53 g/mol
LogP5.43
Rot. Bonds7

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

N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide (PubChem CID 16999316) has the molecular formula C28H25N3O2 and a molecular weight of 435.53 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
PubChem CID16999316
Molecular FormulaC28H25N3O2
Molecular Weight435.53 g/mol
Exact Mass435.19
IUPAC NameN-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
SMILESCN(Cc1ccccc1)C(=O)Cn1c(COc2ccc3ccccc3c2)nc2ccccc21
InChIInChI=1S/C28H25N3O2/c1-30(18-21-9-3-2-4-10-21)28(32)19-31-26-14-8-7-13-25(26)29-27(31)20-33-24-16-15-22-11-5-6-12-23(22)17-24/h2-17H,18-20H2,1H3
InChIKeyAOUCDZRMZSCVIZ-UHFFFAOYSA-N
XLogP5.43
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.53
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[2-(phenoxymethyl)benzimidazol-1-yl]-N-(thiophen-3-ylmethyl)acetamide
CID 60600997
N,N-bis(2-methylpropyl)-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide
CID 16999311
N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 17474837
2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]-N-[(2R)-4-phenylbutan-2-yl]acetamide
CID 32735745
N-benzyl-N-methyl-2-[2-[(4-phenylphenyl)methyl]benzimidazol-1-yl]acetamide
CID 16987485
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 37207886
N-benzyl-N-methyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide
CID 16996582
1-(azepan-1-yl)-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]ethanone
CID 16999317
N-benzyl-N-methyl-2-[2-[3-[(2-phenoxyacetyl)amino]propyl]benzimidazol-1-yl]acetamide
CID 16986352
N-[2-[1-[2-[benzyl(methyl)amino]-2-oxoethyl]benzimidazol-2-yl]ethyl]-2-phenylacetamide
CID 16979045
N-benzyl-N-cyclohexyl-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 16997050
N-benzyl-N-methyl-2-[2-[5-[(2-phenoxyacetyl)amino]pentyl]benzimidazol-1-yl]acetamide
CID 16992973

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide (CID 16999316) is N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide is CN(Cc1ccccc1)C(=O)Cn1c(COc2ccc3ccccc3c2)nc2ccccc21.
What is the InChIKey of N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
The InChIKey is AOUCDZRMZSCVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25N3O2/c1-30(18-21-9-3-2-4-10-21)28(32)19-31-26-14-8-7-13-25(26)29-27(31)20-33-24-16-15-22-11-5-6-12-23(22)17-24/h2-17H,18-20H2,1H3.
What are the key properties of N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide?
N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide has a molecular weight of 435.53 g/mol, XLogP of 5.43, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-[2-(naphthalen-2-yloxymethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 16999316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).