N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide

C24H23N3O2 — CID 16998881

IUPACN-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide
SMILESCC(Oc1ccccc1)c1nc2ccccc2n1CC(=O)N(C)c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-18(29-20-13-7-4-8-14-20)24-25-21-15-9-10-16-22(21)27(24)17-23(28)26(2)19-11-5-3-6-12-19/h3-16,18H,17H2,1-2H3
InChIKeyJBPYGDRUXQRRCC-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.84
Rot. Bonds6

About N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide

N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide (PubChem CID 16998881) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide
PubChem CID16998881
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC NameN-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide
SMILESCC(Oc1ccccc1)c1nc2ccccc2n1CC(=O)N(C)c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-18(29-20-13-7-4-8-14-20)24-25-21-15-9-10-16-22(21)27(24)17-23(28)26(2)19-11-5-3-6-12-19/h3-16,18H,17H2,1-2H3
InChIKeyJBPYGDRUXQRRCC-UHFFFAOYSA-N
XLogP4.84
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

propan-2-yl 2-[2-(1-phenoxyethyl)benzimidazol-1-yl]acetate
CID 16998895
2-[2-[1-[(2-methoxyacetyl)amino]ethyl]benzimidazol-1-yl]-N-methyl-N-phenylacetamide
CID 16969289
1-ethyl-2-(1-phenoxyethyl)benzimidazole
CID 2984876
2-[2-[1-(4-chloro-3-methylphenoxy)ethyl]benzimidazol-1-yl]-N-phenyl-N-propan-2-ylacetamide
CID 16999203
2-(3,4-dimethoxyphenyl)-N-[1-[1-[2-(N-methylanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]acetamide
CID 16972964
N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]acetamide
CID 18877755
2-[(1R)-1-phenoxyethyl]-1-(2-phenoxyethyl)benzimidazole
CID 7574593
N-methyl-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-phenylacetamide
CID 36676558
N-(2-chloro-4-methylphenyl)-2-[2-[(1R)-1-phenoxyethyl]benzimidazol-1-yl]acetamide
CID 40704872
2-[2-(3-hydroxypropyl)benzimidazol-1-yl]-N-methyl-N-phenylacetamide
CID 16995539
N-benzyl-N-methyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide
CID 16996582
2-chloro-N-[[1-[2-(N-methylanilino)-2-oxoethyl]benzimidazol-2-yl]methyl]benzamide
CID 17007545

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide?
The IUPAC name of N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide (CID 16998881) is N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide?
The canonical SMILES for N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide is CC(Oc1ccccc1)c1nc2ccccc2n1CC(=O)N(C)c1ccccc1.
What is the InChIKey of N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide?
The InChIKey is JBPYGDRUXQRRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-18(29-20-13-7-4-8-14-20)24-25-21-15-9-10-16-22(21)27(24)17-23(28)26(2)19-11-5-3-6-12-19/h3-16,18H,17H2,1-2H3.
What are the key properties of N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide?
N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide has a molecular weight of 385.47 g/mol, XLogP of 4.84, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(1-phenoxyethyl)benzimidazol-1-yl]-N-phenylacetamide is sourced from PubChem (CID 16998881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).