ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate

C16H21NO4 — CID 99990777

IUPACethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate
SMILESCCOC(=O)c1c(C)n(CCOC)c2ccc(OC)cc12
InChIInChI=1S/C16H21NO4/c1-5-21-16(18)15-11(2)17(8-9-19-3)14-7-6-12(20-4)10-13(14)15/h6-7,10H,5,8-9H2,1-4H3
InChIKeyRIMWMXJIQUJRKX-UHFFFAOYSA-N
MW291.35 g/mol
LogP2.78
Rot. Bonds6

About ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate

ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate (PubChem CID 99990777) has the molecular formula C16H21NO4 and a molecular weight of 291.35 g/mol. Its IUPAC name is ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate.

Molecular Properties

Compound Nameethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate
PubChem CID99990777
Molecular FormulaC16H21NO4
Molecular Weight291.35 g/mol
Exact Mass291.15
IUPAC Nameethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate
SMILESCCOC(=O)c1c(C)n(CCOC)c2ccc(OC)cc12
InChIInChI=1S/C16H21NO4/c1-5-21-16(18)15-11(2)17(8-9-19-3)14-7-6-12(20-4)10-13(14)15/h6-7,10H,5,8-9H2,1-4H3
InChIKeyRIMWMXJIQUJRKX-UHFFFAOYSA-N
XLogP2.78
TPSA49.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 5-cyclopentyloxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate
CID 99991134
ethyl 5-methoxy-2-methyl-1-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]indole-3-carboxylate
CID 6979080
ethyl 5-methoxy-2-methyl-1-methylsulfonylindole-3-carboxylate
CID 23589053
1-[2-chloro-5-methoxy-1-(2-methoxyethyl)indol-3-yl]ethanone
CID 82268904
ethyl 1-(benzenesulfonyl)-5-methoxy-2-methylindole-3-carboxylate
CID 10937613
tetraethyl 6-methoxynaphthalene-1,2,3,4-tetracarboxylate
CID 11733003
ethyl 1-[2-[(2E)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-5-methoxy-2-methylindole-3-carboxylate
CID 11697608
ethyl 5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxoethoxy]-1-(2-hydroxyethyl)-2-methylindole-3-carboxylate
CID 125113663
ethyl 1-(4-methoxyphenyl)-2-methyl-5-(2-phenoxyethoxy)indole-3-carboxylate
CID 2076757
ethyl 5-hydroxy-2-methyl-1-(2-naphthalen-1-yloxyethyl)indole-3-carboxylate
CID 1036735
ethyl 5-methoxy-2-methyl-1-[3-(trifluoromethyl)phenyl]indole-3-carboxylate
CID 56690107
N-(1-hydroxypentan-3-yl)-5-methoxy-2-methyl-1-propylindole-3-carboxamide
CID 109479265

Frequently Asked Questions

What is the IUPAC name of ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate?
The IUPAC name of ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate (CID 99990777) is ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate.
What is the SMILES notation for ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate?
The canonical SMILES for ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate is CCOC(=O)c1c(C)n(CCOC)c2ccc(OC)cc12.
What is the InChIKey of ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate?
The InChIKey is RIMWMXJIQUJRKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO4/c1-5-21-16(18)15-11(2)17(8-9-19-3)14-7-6-12(20-4)10-13(14)15/h6-7,10H,5,8-9H2,1-4H3.
What are the key properties of ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate?
ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate has a molecular weight of 291.35 g/mol, XLogP of 2.78, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 5-methoxy-1-(2-methoxyethyl)-2-methylindole-3-carboxylate is sourced from PubChem (CID 99990777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).