2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide

C20H24N2O4 — CID 4879365

IUPAC2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)CN2c3ccccc3CC2C)cc(OC)c1OC
InChIInChI=1S/C20H24N2O4/c1-13-9-14-7-5-6-8-16(14)22(13)12-19(23)21-15-10-17(24-2)20(26-4)18(11-15)25-3/h5-8,10-11,13H,9,12H2,1-4H3,(H,21,23)
InChIKeyHBYYVPXZGCPKQM-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.10
Rot. Bonds6

About 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide

2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 4879365) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID4879365
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)CN2c3ccccc3CC2C)cc(OC)c1OC
InChIInChI=1S/C20H24N2O4/c1-13-9-14-7-5-6-8-16(14)22(13)12-19(23)21-15-10-17(24-2)20(26-4)18(11-15)25-3/h5-8,10-11,13H,9,12H2,1-4H3,(H,21,23)
InChIKeyHBYYVPXZGCPKQM-UHFFFAOYSA-N
XLogP3.10
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (CID 4879365) is 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide is COc1cc(NC(=O)CN2c3ccccc3CC2C)cc(OC)c1OC.
What is the InChIKey of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is HBYYVPXZGCPKQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-13-9-14-7-5-6-8-16(14)22(13)12-19(23)21-15-10-17(24-2)20(26-4)18(11-15)25-3/h5-8,10-11,13H,9,12H2,1-4H3,(H,21,23).
What are the key properties of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 356.42 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 4879365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).