ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate

C19H19NO2 — CID 10541758

IUPACethyl 2-(2-methyl-1-phenylindol-3-yl)acetate
SMILESCCOC(=O)Cc1c(C)n(-c2ccccc2)c2ccccc12
InChIInChI=1S/C19H19NO2/c1-3-22-19(21)13-17-14(2)20(15-9-5-4-6-10-15)18-12-8-7-11-16(17)18/h4-12H,3,13H2,1-2H3
InChIKeyGWRYXJUJMJMNEZ-UHFFFAOYSA-N
MW293.37 g/mol
LogP4.04
Rot. Bonds4

About ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate

ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate (PubChem CID 10541758) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(2-methyl-1-phenylindol-3-yl)acetate
PubChem CID10541758
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Nameethyl 2-(2-methyl-1-phenylindol-3-yl)acetate
SMILESCCOC(=O)Cc1c(C)n(-c2ccccc2)c2ccccc12
InChIInChI=1S/C19H19NO2/c1-3-22-19(21)13-17-14(2)20(15-9-5-4-6-10-15)18-12-8-7-11-16(17)18/h4-12H,3,13H2,1-2H3
InChIKeyGWRYXJUJMJMNEZ-UHFFFAOYSA-N
XLogP4.04
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methyl-1-phenylindol-3-yl)ethanamine
CID 744625
1-O-tert-butyl 2-O-ethyl 3-(2-ethoxy-2-oxoethyl)indole-1,2-dicarboxylate
CID 59409118
ethyl 2-[2-methyl-1-[(3R,4R)-4-methylpyrrolidin-3-yl]indol-3-yl]acetate
CID 90274023
ethyl 2-(methylaminomethyl)-1-phenylindole-3-carboxylate
CID 170071224
methyl 2-(2-methyl-1-pyridin-2-ylindol-3-yl)acetate
CID 132539705
ethyl 3-(1-phenylindol-3-yl)propanoate
CID 154127482
ethyl 2-[2-methyl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-3-yl]acetate
CID 151007121
ethyl 4-(2-ethoxy-2-oxoethyl)-5-phenylimidazo[1,5-a]quinoline-3-carboxylate
CID 127044085
2-(1,2-dimethylindol-3-yl)acetamide
CID 67627690
ethyl 2-(1-methyl-3-nitro-2-oxoquinolin-4-yl)acetate
CID 2785575
2-(2-methyl-1-phenylindol-3-yl)-N-[(E)-1-pyridin-2-ylethylideneamino]acetamide
CID 27877008
diethyl 3,4-dihydroxy-1-phenylpyrrole-2,5-dicarboxylate
CID 2801528

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate?
The IUPAC name of ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate (CID 10541758) is ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate.
What is the SMILES notation for ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate?
The canonical SMILES for ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate is CCOC(=O)Cc1c(C)n(-c2ccccc2)c2ccccc12.
What is the InChIKey of ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate?
The InChIKey is GWRYXJUJMJMNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2/c1-3-22-19(21)13-17-14(2)20(15-9-5-4-6-10-15)18-12-8-7-11-16(17)18/h4-12H,3,13H2,1-2H3.
What are the key properties of ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate?
ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate has a molecular weight of 293.37 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-methyl-1-phenylindol-3-yl)acetate is sourced from PubChem (CID 10541758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).