methyl 2-(1H-indol-2-yloxy)acetate

C11H11NO3 — CID 67824553

IUPACmethyl 2-(1H-indol-2-yloxy)acetate
SMILESCOC(=O)COc1cc2ccccc2[nH]1
InChIInChI=1S/C11H11NO3/c1-14-11(13)7-15-10-6-8-4-2-3-5-9(8)12-10/h2-6,12H,7H2,1H3
InChIKeyZKNCGJIFEOXCAX-UHFFFAOYSA-N
MW205.21 g/mol
LogP1.72
Rot. Bonds3

About methyl 2-(1H-indol-2-yloxy)acetate

methyl 2-(1H-indol-2-yloxy)acetate (PubChem CID 67824553) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is methyl 2-(1H-indol-2-yloxy)acetate.

Molecular Properties

Compound Namemethyl 2-(1H-indol-2-yloxy)acetate
PubChem CID67824553
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Namemethyl 2-(1H-indol-2-yloxy)acetate
SMILESCOC(=O)COc1cc2ccccc2[nH]1
InChIInChI=1S/C11H11NO3/c1-14-11(13)7-15-10-6-8-4-2-3-5-9(8)12-10/h2-6,12H,7H2,1H3
InChIKeyZKNCGJIFEOXCAX-UHFFFAOYSA-N
XLogP1.72
TPSA51.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-(1H-indol-2-ylsulfanyl)acetate
CID 10727704
1H-indol-2-yl N-(2-acetamidoethyl)carbamate
CID 91346981
methyl (3S)-3-(1H-indol-2-yl)-3-phenylpropanoate
CID 102574001
methyl 2-[4-(1H-indol-2-ylmethyl)phenyl]acetate
CID 70109234
2-prop-2-ynoxy-1H-indole
CID 57088946
3-(1H-indol-2-yloxy)propane-1,2-diol
CID 23048023
methyl N-(1H-indol-2-yl)carbamate
CID 68950849
methyl 2-[3-(2-methoxy-2-oxoethoxy)phenoxy]acetate
CID 6420588
methyl 6-(1H-indole-2-carbonylamino)hexanoate
CID 43407298
dimethyl 2-(1H-indol-2-ylmethyl)propanedioate
CID 132519173
methyl 3-(1H-indole-2-carbonylamino)pentanoate
CID 112533189
methyl 2-[2-(1H-benzimidazol-2-yl)-4-bromophenoxy]acetate
CID 168554534

Frequently Asked Questions

What is the IUPAC name of methyl 2-(1H-indol-2-yloxy)acetate?
The IUPAC name of methyl 2-(1H-indol-2-yloxy)acetate (CID 67824553) is methyl 2-(1H-indol-2-yloxy)acetate.
What is the SMILES notation for methyl 2-(1H-indol-2-yloxy)acetate?
The canonical SMILES for methyl 2-(1H-indol-2-yloxy)acetate is COC(=O)COc1cc2ccccc2[nH]1.
What is the InChIKey of methyl 2-(1H-indol-2-yloxy)acetate?
The InChIKey is ZKNCGJIFEOXCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-14-11(13)7-15-10-6-8-4-2-3-5-9(8)12-10/h2-6,12H,7H2,1H3.
What are the key properties of methyl 2-(1H-indol-2-yloxy)acetate?
methyl 2-(1H-indol-2-yloxy)acetate has a molecular weight of 205.21 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(1H-indol-2-yloxy)acetate is sourced from PubChem (CID 67824553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).