2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide

C17H21N5O — CID 51102469

IUPAC2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
SMILESCCc1nc2ccccc2n1CC(=O)NCCc1nccn1C
InChIInChI=1S/C17H21N5O/c1-3-15-20-13-6-4-5-7-14(13)22(15)12-17(23)19-9-8-16-18-10-11-21(16)2/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,19,23)
InChIKeyKTOYPQMWLIDHSL-UHFFFAOYSA-N
MW311.39 g/mol
LogP1.69
Rot. Bonds6

About 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide

2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide (PubChem CID 51102469) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
PubChem CID51102469
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
SMILESCCc1nc2ccccc2n1CC(=O)NCCc1nccn1C
InChIInChI=1S/C17H21N5O/c1-3-15-20-13-6-4-5-7-14(13)22(15)12-17(23)19-9-8-16-18-10-11-21(16)2/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,19,23)
InChIKeyKTOYPQMWLIDHSL-UHFFFAOYSA-N
XLogP1.69
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethylbenzimidazol-1-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
CID 55855526
2-(2-ethylbenzimidazol-1-yl)-N-[(S)-(1-methylimidazol-2-yl)-phenylmethyl]acetamide
CID 31357913
2-[2-(2-acetamidoethyl)benzimidazol-1-yl]-N-butylacetamide
CID 17030211
2-(2-ethylbenzimidazol-1-yl)-N-(2-naphthalen-1-yloxyethyl)acetamide
CID 55889267
2-(2-ethylbenzimidazol-1-yl)-N-[4-(4-methylphenoxy)butyl]acetamide
CID 55799713
N-[2-[1-[2-(butylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030651
4-methyl-N-[2-[1-[2-oxo-2-(propylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030844
N-[2-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]ethyl]butanamide
CID 17030370
2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 115572979
2-(2-ethylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 4789521
2-(2-ethylbenzimidazol-1-yl)-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]acetamide
CID 39619634
3-[2-(1-methylimidazol-2-yl)ethylamino]-3-oxopropanoic acid
CID 62232290

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide (CID 51102469) is 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide is CCc1nc2ccccc2n1CC(=O)NCCc1nccn1C.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
The InChIKey is KTOYPQMWLIDHSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c1-3-15-20-13-6-4-5-7-14(13)22(15)12-17(23)19-9-8-16-18-10-11-21(16)2/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,19,23).
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide?
2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide has a molecular weight of 311.39 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 51102469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).