N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide

C22H21N3O — CID 17033441

IUPACN-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
SMILESCCNC(=O)Cn1c(Cc2cccc3ccccc23)nc2ccccc21
InChIInChI=1S/C22H21N3O/c1-2-23-22(26)15-25-20-13-6-5-12-19(20)24-21(25)14-17-10-7-9-16-8-3-4-11-18(16)17/h3-13H,2,14-15H2,1H3,(H,23,26)
InChIKeyYXADRULZEBYTFX-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.92
Rot. Bonds5

About N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide

N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide (PubChem CID 17033441) has the molecular formula C22H21N3O and a molecular weight of 343.43 g/mol. Its IUPAC name is N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
PubChem CID17033441
Molecular FormulaC22H21N3O
Molecular Weight343.43 g/mol
Exact Mass343.17
IUPAC NameN-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
SMILESCCNC(=O)Cn1c(Cc2cccc3ccccc23)nc2ccccc21
InChIInChI=1S/C22H21N3O/c1-2-23-22(26)15-25-20-13-6-5-12-19(20)24-21(25)14-17-10-7-9-16-8-3-4-11-18(16)17/h3-13H,2,14-15H2,1H3,(H,23,26)
InChIKeyYXADRULZEBYTFX-UHFFFAOYSA-N
XLogP3.92
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
CID 17033393
N-(3-methylsulfanylphenyl)-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
CID 17033417
2-[2-(acetamidomethyl)benzimidazol-1-yl]-N-ethylacetamide
CID 17028901
N-ethyl-2-(2-phenylbenzimidazol-1-yl)acetamide
CID 17032718
N-[[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]methyl]butanamide
CID 16968882
N-ethyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide
CID 17028648
N-[2-[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]ethyl]butanamide
CID 16974420
2-(2-ethylbenzimidazol-1-yl)-N-(2-naphthalen-1-yloxyethyl)acetamide
CID 55889267
N-(3-ethoxypropyl)-2-[2-[(2-methylphenyl)methyl]benzimidazol-1-yl]acetamide
CID 17032388
N-[3-[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]propyl]propanamide
CID 16980695
N-[(4-methoxyphenyl)methyl]-2-(2-propylbenzimidazol-1-yl)acetamide
CID 17028685
N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide
CID 4610410

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide (CID 17033441) is N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide is CCNC(=O)Cn1c(Cc2cccc3ccccc23)nc2ccccc21.
What is the InChIKey of N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide?
The InChIKey is YXADRULZEBYTFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O/c1-2-23-22(26)15-25-20-13-6-5-12-19(20)24-21(25)14-17-10-7-9-16-8-3-4-11-18(16)17/h3-13H,2,14-15H2,1H3,(H,23,26).
What are the key properties of N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide?
N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide has a molecular weight of 343.43 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 17033441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).