2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide

C18H19N3O2 — CID 51190450

IUPAC2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)NCCOc1ccccc1
InChIInChI=1S/C18H19N3O2/c1-14-20-16-9-5-6-10-17(16)21(14)13-18(22)19-11-12-23-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,19,22)
InChIKeyNMUKTTGNKRQLFM-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.54
Rot. Bonds6

About 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide

2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide (PubChem CID 51190450) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide.

Molecular Properties

Compound Name2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide
PubChem CID51190450
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)NCCOc1ccccc1
InChIInChI=1S/C18H19N3O2/c1-14-20-16-9-5-6-10-17(16)21(14)13-18(22)19-11-12-23-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,19,22)
InChIKeyNMUKTTGNKRQLFM-UHFFFAOYSA-N
XLogP2.54
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-methylbenzimidazol-1-yl)ethyl]-4-phenoxybutanamide
CID 40716506
N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 24583706
N-(2-acetamidoethyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 47131203
N-[3-(2-methylbenzimidazol-1-yl)propyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 112767743
N-(2-methoxyethyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 35805150
2-(9-oxoacridin-10-yl)-N-(2-phenoxyethyl)acetamide
CID 26024228
2-(2-ethylbenzimidazol-1-yl)-N-[4-(4-methylphenoxy)butyl]acetamide
CID 55799713
2-(2-methylbenzimidazol-1-yl)acetic acid
CID 75530217
2-(2-methylbenzimidazol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 848727
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(3-phenoxypropyl)acetamide
CID 18142814
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(3-phenoxypropyl)acetamide
CID 18121552
2-[2-(4-methoxyphenyl)benzimidazol-1-yl]-N-propylacetamide
CID 17033010

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide?
The IUPAC name of 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide (CID 51190450) is 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide.
What is the SMILES notation for 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide?
The canonical SMILES for 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide is Cc1nc2ccccc2n1CC(=O)NCCOc1ccccc1.
What is the InChIKey of 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide?
The InChIKey is NMUKTTGNKRQLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-14-20-16-9-5-6-10-17(16)21(14)13-18(22)19-11-12-23-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,19,22).
What are the key properties of 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide?
2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide has a molecular weight of 309.37 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide is sourced from PubChem (CID 51190450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).