2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide

C18H18FN3O — CID 26286960

IUPAC2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide
SMILESCCc1nc2ccccc2n1CC(=O)Nc1ccc(F)cc1C
InChIInChI=1S/C18H18FN3O/c1-3-17-20-15-6-4-5-7-16(15)22(17)11-18(23)21-14-9-8-13(19)10-12(14)2/h4-10H,3,11H2,1-2H3,(H,21,23)
InChIKeyZCDXJNBMNDGNKF-UHFFFAOYSA-N
MW311.36 g/mol
LogP3.68
Rot. Bonds4

About 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide

2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide (PubChem CID 26286960) has the molecular formula C18H18FN3O and a molecular weight of 311.36 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide
PubChem CID26286960
Molecular FormulaC18H18FN3O
Molecular Weight311.36 g/mol
Exact Mass311.14
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide
SMILESCCc1nc2ccccc2n1CC(=O)Nc1ccc(F)cc1C
InChIInChI=1S/C18H18FN3O/c1-3-17-20-15-6-4-5-7-16(15)22(17)11-18(23)21-14-9-8-13(19)10-12(14)2/h4-10H,3,11H2,1-2H3,(H,21,23)
InChIKeyZCDXJNBMNDGNKF-UHFFFAOYSA-N
XLogP3.68
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 4789521
2-(2-ethylbenzimidazol-1-yl)-N-(2-methoxyphenyl)acetamide
CID 5023490
N-ethyl-3-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-4-methylbenzamide
CID 55782666
N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 55899331
2-(2-benzylbenzimidazol-1-yl)-N-(2-methylphenyl)acetamide
CID 17032346
2-[2-[(2-chlorophenoxy)methyl]benzimidazol-1-yl]-N-(2,4-dimethylphenyl)acetamide
CID 17031887
2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone
CID 60975590
N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 3460449
2-(2-ethylbenzimidazol-1-yl)-N-(3-methylsulfonylphenyl)acetamide
CID 27335104
1-(3,5-dimethylphenyl)-3-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]thiourea
CID 40696855
2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 115572979
2-[2-[(4-chloro-3-methylphenoxy)methyl]benzimidazol-1-yl]-N-(2,4-dimethylphenyl)acetamide
CID 17032131

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide (CID 26286960) is 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide is CCc1nc2ccccc2n1CC(=O)Nc1ccc(F)cc1C.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide?
The InChIKey is ZCDXJNBMNDGNKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O/c1-3-17-20-15-6-4-5-7-16(15)22(17)11-18(23)21-14-9-8-13(19)10-12(14)2/h4-10H,3,11H2,1-2H3,(H,21,23).
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide?
2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide has a molecular weight of 311.36 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-N-(4-fluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 26286960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).