N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide

C19H20N2O3 — CID 110732644

IUPACN-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)NCCn1ccc2ccccc21
InChIInChI=1S/C19H20N2O3/c1-23-16-8-5-9-17(24-2)18(16)19(22)20-11-13-21-12-10-14-6-3-4-7-15(14)21/h3-10,12H,11,13H2,1-2H3,(H,20,22)
InChIKeyHTPGWZLOQVMPJX-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.09
Rot. Bonds6

About N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide

N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide (PubChem CID 110732644) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide
PubChem CID110732644
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide
SMILESCOc1cccc(OC)c1C(=O)NCCn1ccc2ccccc21
InChIInChI=1S/C19H20N2O3/c1-23-16-8-5-9-17(24-2)18(16)19(22)20-11-13-21-12-10-14-6-3-4-7-15(14)21/h3-10,12H,11,13H2,1-2H3,(H,20,22)
InChIKeyHTPGWZLOQVMPJX-UHFFFAOYSA-N
XLogP3.09
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-indol-1-ylpropyl)-3,5-dimethoxy-4-methylbenzamide
CID 25343089
N-(3-indol-1-ylpropyl)-2-(2-methoxyphenoxy)acetamide
CID 18120698
N-(3-indol-1-ylpropyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 55791961
3-ethoxy-N-(2-indol-1-ylethyl)benzamide
CID 108726430
N-(2-indol-1-ylethyl)-4-phenylbenzamide
CID 4251768
N-(2-indol-1-ylethyl)-2-iodobenzamide
CID 3247556
(E)-N-(2-indol-1-ylethyl)but-2-enamide
CID 108750473
1,1-diethyl-3-(2-indol-1-ylethyl)urea
CID 108726423
N-(3-indol-1-ylpropyl)-2-methoxy-5-sulfamoylbenzamide
CID 17401615
N-(2-indol-1-ylethyl)-4-(2-methylpropoxy)benzamide
CID 108726376
2,2,2-trifluoro-N-(2-indol-1-ylethyl)acetamide
CID 108750477
2,6-dimethoxy-N-(2-methoxyethyl)benzamide
CID 4128287

Frequently Asked Questions

What is the IUPAC name of N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide?
The IUPAC name of N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide (CID 110732644) is N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide.
What is the SMILES notation for N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide?
The canonical SMILES for N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide is COc1cccc(OC)c1C(=O)NCCn1ccc2ccccc21.
What is the InChIKey of N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide?
The InChIKey is HTPGWZLOQVMPJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-23-16-8-5-9-17(24-2)18(16)19(22)20-11-13-21-12-10-14-6-3-4-7-15(14)21/h3-10,12H,11,13H2,1-2H3,(H,20,22).
What are the key properties of N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide?
N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide has a molecular weight of 324.38 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-indol-1-ylethyl)-2,6-dimethoxybenzamide is sourced from PubChem (CID 110732644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).