2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide

C23H21N3O2 — CID 24995064

IUPAC2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide
SMILESCc1ccccc1Cn1c(-c2ccccc2OCC(N)=O)nc2ccccc21
InChIInChI=1S/C23H21N3O2/c1-16-8-2-3-9-17(16)14-26-20-12-6-5-11-19(20)25-23(26)18-10-4-7-13-21(18)28-15-22(24)27/h2-13H,14-15H2,1H3,(H2,24,27)
InChIKeyYXZGZPJNHSRACO-UHFFFAOYSA-N
MW371.44 g/mol
LogP3.92
Rot. Bonds6

About 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide

2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide (PubChem CID 24995064) has the molecular formula C23H21N3O2 and a molecular weight of 371.44 g/mol. Its IUPAC name is 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide
PubChem CID24995064
Molecular FormulaC23H21N3O2
Molecular Weight371.44 g/mol
Exact Mass371.16
IUPAC Name2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide
SMILESCc1ccccc1Cn1c(-c2ccccc2OCC(N)=O)nc2ccccc21
InChIInChI=1S/C23H21N3O2/c1-16-8-2-3-9-17(16)14-26-20-12-6-5-11-19(20)25-23(26)18-10-4-7-13-21(18)28-15-22(24)27/h2-13H,14-15H2,1H3,(H2,24,27)
InChIKeyYXZGZPJNHSRACO-UHFFFAOYSA-N
XLogP3.92
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[1-[(2,6-dimethylphenyl)methyl]-6-fluorobenzimidazol-2-yl]phenoxy]acetamide
CID 24995061
2-[2-[7-chloro-1-[(2,6-dichlorophenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide
CID 24995997
1-[(2-methylphenyl)methyl]-2-phenylbenzimidazole
CID 1320430
4-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]aniline
CID 92629106
2-(3-methylphenyl)-1-[(2-methylphenyl)methyl]benzimidazole
CID 17000755
2-[2-[2-[3-(dimethylamino)propoxy]phenyl]benzimidazol-1-yl]acetic acid
CID 20993307
2-[2-(2-methylphenyl)benzimidazol-1-yl]acetic acid
CID 43349122
2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol
CID 17027842
2-(5-methylfuran-2-yl)-1-[(2-methylphenyl)methyl]benzimidazole
CID 129161859
2-ethyl-N-[1-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethyl]butanamide
CID 16969021
2-(2-chlorophenyl)-1-[(2-chlorophenyl)methyl]benzimidazole
CID 3596016
[4-[[2-(2-methylphenyl)benzimidazol-1-yl]methyl]phenyl]methanamine
CID 82150130

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide?
The IUPAC name of 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide (CID 24995064) is 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide?
The canonical SMILES for 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide is Cc1ccccc1Cn1c(-c2ccccc2OCC(N)=O)nc2ccccc21.
What is the InChIKey of 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide?
The InChIKey is YXZGZPJNHSRACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O2/c1-16-8-2-3-9-17(16)14-26-20-12-6-5-11-19(20)25-23(26)18-10-4-7-13-21(18)28-15-22(24)27/h2-13H,14-15H2,1H3,(H2,24,27).
What are the key properties of 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide?
2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide has a molecular weight of 371.44 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]phenoxy]acetamide is sourced from PubChem (CID 24995064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).