5-methoxy-1-(1-phenylethenyl)indole

C17H15NO — CID 175370512

IUPAC5-methoxy-1-(1-phenylethenyl)indole
SMILESC=C(c1ccccc1)n1ccc2cc(OC)ccc21
InChIInChI=1S/C17H15NO/c1-13(14-6-4-3-5-7-14)18-11-10-15-12-16(19-2)8-9-17(15)18/h3-12H,1H2,2H3
InChIKeyLSRQAMYIDYOIFZ-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.17
Rot. Bonds3

About 5-methoxy-1-(1-phenylethenyl)indole

5-methoxy-1-(1-phenylethenyl)indole (PubChem CID 175370512) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-methoxy-1-(1-phenylethenyl)indole.

Molecular Properties

Compound Name5-methoxy-1-(1-phenylethenyl)indole
PubChem CID175370512
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name5-methoxy-1-(1-phenylethenyl)indole
SMILESC=C(c1ccccc1)n1ccc2cc(OC)ccc21
InChIInChI=1S/C17H15NO/c1-13(14-6-4-3-5-7-14)18-11-10-15-12-16(19-2)8-9-17(15)18/h3-12H,1H2,2H3
InChIKeyLSRQAMYIDYOIFZ-UHFFFAOYSA-N
XLogP4.17
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxyindole-1-carboxylic acid
CID 68566461
N-benzyl-5-methoxyindole-1-carboxamide
CID 11055060
5-methoxy-N-(4-methoxyphenyl)indole-1-carboxamide
CID 173299571
5-methoxy-1-methylindole
CID 819864
N-benzyl-N-(2-bromophenyl)-5-methoxyindole-1-carboxamide
CID 102348592
(5-methoxyindol-1-yl)-(5-methoxy-1H-indol-2-yl)methanone
CID 139083916
cyanomethyl 5-methoxyindole-1-carboxylate
CID 141286697
5-methoxy-1-(3-phenoxypropyl)indole
CID 110831444
(2S)-2-(diethylamino)-1-(5-methoxyindol-1-yl)propan-1-one
CID 170000579
2-fluoro-4-methoxy-1-(1-phenylethenyl)benzene
CID 156698107
(E)-1-(5-chloroindol-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one
CID 56683799
1-methoxy-3-(1-phenylethenyl)benzene
CID 15680509

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-(1-phenylethenyl)indole?
The IUPAC name of 5-methoxy-1-(1-phenylethenyl)indole (CID 175370512) is 5-methoxy-1-(1-phenylethenyl)indole.
What is the SMILES notation for 5-methoxy-1-(1-phenylethenyl)indole?
The canonical SMILES for 5-methoxy-1-(1-phenylethenyl)indole is C=C(c1ccccc1)n1ccc2cc(OC)ccc21.
What is the InChIKey of 5-methoxy-1-(1-phenylethenyl)indole?
The InChIKey is LSRQAMYIDYOIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-13(14-6-4-3-5-7-14)18-11-10-15-12-16(19-2)8-9-17(15)18/h3-12H,1H2,2H3.
What are the key properties of 5-methoxy-1-(1-phenylethenyl)indole?
5-methoxy-1-(1-phenylethenyl)indole has a molecular weight of 249.31 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-(1-phenylethenyl)indole is sourced from PubChem (CID 175370512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).