2-ethenyl-5-methoxy-1H-indole

C11H11NO — CID 11844226

IUPAC2-ethenyl-5-methoxy-1H-indole
SMILESC=Cc1cc2cc(OC)ccc2[nH]1
InChIInChI=1S/C11H11NO/c1-3-9-6-8-7-10(13-2)4-5-11(8)12-9/h3-7,12H,1H2,2H3
InChIKeyYCEHKOJSKAMBOS-UHFFFAOYSA-N
MW173.21 g/mol
LogP2.82
Rot. Bonds2

About 2-ethenyl-5-methoxy-1H-indole

2-ethenyl-5-methoxy-1H-indole (PubChem CID 11844226) has the molecular formula C11H11NO and a molecular weight of 173.21 g/mol. Its IUPAC name is 2-ethenyl-5-methoxy-1H-indole.

Molecular Properties

Compound Name2-ethenyl-5-methoxy-1H-indole
PubChem CID11844226
Molecular FormulaC11H11NO
Molecular Weight173.21 g/mol
Exact Mass173.08
IUPAC Name2-ethenyl-5-methoxy-1H-indole
SMILESC=Cc1cc2cc(OC)ccc2[nH]1
InChIInChI=1S/C11H11NO/c1-3-9-6-8-7-10(13-2)4-5-11(8)12-9/h3-7,12H,1H2,2H3
InChIKeyYCEHKOJSKAMBOS-UHFFFAOYSA-N
XLogP2.82
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(E)-2-(2-bromophenyl)ethenyl]-5-methoxy-1H-indole
CID 11843963
5-methoxy-1H-indole-2-thiol
CID 119094198
ethyl (E)-3-(5-methoxy-1H-indol-2-yl)prop-2-enoate
CID 24741227
methyl 2-methoxy-5-(5-methoxy-1H-indol-2-yl)penta-2,4-dienoate
CID 54063713
ethane;2-[(E)-2-(4-methoxyphenyl)ethenyl]-1H-indole
CID 143581960
3-amino-6-methoxy-1H-quinolin-2-one
CID 115018057
2-(5-methoxy-1H-indol-2-yl)ethanamine
CID 11217728
2-[(2R)-aziridin-2-yl]-5-methoxy-1H-indole
CID 55263506
5-methoxy-2-(1H-pyrazol-5-yl)-1H-indole
CID 135496116
5-methoxy-2-(1H-pyrrol-2-yl)-1H-indole
CID 66573117
2-cyclobutyl-5-methoxy-1H-indole
CID 84670139
3-(hydroxymethyl)-6-methoxy-1H-quinolin-2-one
CID 865120

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-5-methoxy-1H-indole?
The IUPAC name of 2-ethenyl-5-methoxy-1H-indole (CID 11844226) is 2-ethenyl-5-methoxy-1H-indole.
What is the SMILES notation for 2-ethenyl-5-methoxy-1H-indole?
The canonical SMILES for 2-ethenyl-5-methoxy-1H-indole is C=Cc1cc2cc(OC)ccc2[nH]1.
What is the InChIKey of 2-ethenyl-5-methoxy-1H-indole?
The InChIKey is YCEHKOJSKAMBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c1-3-9-6-8-7-10(13-2)4-5-11(8)12-9/h3-7,12H,1H2,2H3.
What are the key properties of 2-ethenyl-5-methoxy-1H-indole?
2-ethenyl-5-methoxy-1H-indole has a molecular weight of 173.21 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-5-methoxy-1H-indole is sourced from PubChem (CID 11844226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).