N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide

C20H22N2O — CID 110831113

IUPACN-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide
SMILESCCc1ccc2c(ccn2CC(=O)Nc2cccc(C)c2C)c1
InChIInChI=1S/C20H22N2O/c1-4-16-8-9-19-17(12-16)10-11-22(19)13-20(23)21-18-7-5-6-14(2)15(18)3/h5-12H,4,13H2,1-3H3,(H,21,23)
InChIKeyOPMSRERJCAQWIK-UHFFFAOYSA-N
MW306.41 g/mol
LogP4.46
Rot. Bonds4

About N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide

N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide (PubChem CID 110831113) has the molecular formula C20H22N2O and a molecular weight of 306.41 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide
PubChem CID110831113
Molecular FormulaC20H22N2O
Molecular Weight306.41 g/mol
Exact Mass306.17
IUPAC NameN-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide
SMILESCCc1ccc2c(ccn2CC(=O)Nc2cccc(C)c2C)c1
InChIInChI=1S/C20H22N2O/c1-4-16-8-9-19-17(12-16)10-11-22(19)13-20(23)21-18-7-5-6-14(2)15(18)3/h5-12H,4,13H2,1-3H3,(H,21,23)
InChIKeyOPMSRERJCAQWIK-UHFFFAOYSA-N
XLogP4.46
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741423
2-(5-ethylindol-1-yl)-N-(4-sulfamoylphenyl)acetamide
CID 110831240
N-(3-amino-2-methylphenyl)-2-indol-1-ylacetamide
CID 43247265
N-(2,3-dimethylphenyl)-2-[4-(4-ethylbenzoyl)piperazin-1-yl]acetamide
CID 27859906
N-(2,3-dimethylphenyl)-5-ethyl-2-hydroxybenzamide
CID 13325046
N-ethyl-2-[5-(ethylaminomethyl)indol-1-yl]acetamide
CID 102915889
N-(2-bromo-4,5-dimethylphenyl)-2-(5-bromoindol-1-yl)acetamide
CID 4048909
N-(2,3-dimethylphenyl)-2-(3,4-dimethylphenyl)acetamide
CID 2599603
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43832718
N-(2,3-dimethylphenyl)-2-(5-ethyl-2-methylpyridin-1-ium-1-yl)acetamide
CID 8862566
N-(2,3-dimethylphenyl)-2-hydroxyacetamide
CID 16769655

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide (CID 110831113) is N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide is CCc1ccc2c(ccn2CC(=O)Nc2cccc(C)c2C)c1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide?
The InChIKey is OPMSRERJCAQWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O/c1-4-16-8-9-19-17(12-16)10-11-22(19)13-20(23)21-18-7-5-6-14(2)15(18)3/h5-12H,4,13H2,1-3H3,(H,21,23).
What are the key properties of N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide?
N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide has a molecular weight of 306.41 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-(5-ethylindol-1-yl)acetamide is sourced from PubChem (CID 110831113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).