2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide

C16H23N3O — CID 115572979

IUPAC2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide
SMILESCCc1nc2ccccc2n1CC(=O)NC(C)(C)CC
InChIInChI=1S/C16H23N3O/c1-5-14-17-12-9-7-8-10-13(12)19(14)11-15(20)18-16(3,4)6-2/h7-10H,5-6,11H2,1-4H3,(H,18,20)
InChIKeyHAIPJOYUNQHNQQ-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.90
Rot. Bonds5

About 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide

2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide (PubChem CID 115572979) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide
PubChem CID115572979
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide
SMILESCCc1nc2ccccc2n1CC(=O)NC(C)(C)CC
InChIInChI=1S/C16H23N3O/c1-5-14-17-12-9-7-8-10-13(12)19(14)11-15(20)18-16(3,4)6-2/h7-10H,5-6,11H2,1-4H3,(H,18,20)
InChIKeyHAIPJOYUNQHNQQ-UHFFFAOYSA-N
XLogP2.90
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.90
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
N-[[1-[2-(tert-butylamino)-2-oxoethyl]benzimidazol-2-yl]methyl]butanamide
CID 17028956
2-(2-ethylbenzimidazol-1-yl)-N-(oxan-4-yl)acetamide
CID 115588669
2-(2-ethylbenzimidazol-1-yl)-N-(2-methoxyphenyl)acetamide
CID 5023490
methyl 3-(2-ethylbenzimidazol-1-yl)-2,2-dimethylpropanoate
CID 79629566
(2S,3S)-2-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-3-methylpentanoic acid
CID 119194002
(2S)-2-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-3-phenylpropanoic acid
CID 119366771
N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 3460449
2-(2-ethylbenzimidazol-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 51219854
2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone
CID 60975590
(2R)-N'-[2-(2-ethylbenzimidazol-1-yl)acetyl]-2-methyl-3-methylsulfanylpropanehydrazide
CID 99805786
2-[2-(3-acetamidopropyl)benzimidazol-1-yl]-N-tert-butylacetamide
CID 17030947

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide (CID 115572979) is 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide is CCc1nc2ccccc2n1CC(=O)NC(C)(C)CC.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is HAIPJOYUNQHNQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-5-14-17-12-9-7-8-10-13(12)19(14)11-15(20)18-16(3,4)6-2/h7-10H,5-6,11H2,1-4H3,(H,18,20).
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 273.38 g/mol, XLogP of 2.90, 5 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-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 115572979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).