1-methyl-3-(1-thiophen-2-ylethyl)indole

C15H15NS — CID 23649825

IUPAC1-methyl-3-(1-thiophen-2-ylethyl)indole
SMILESCC(c1cccs1)c1cn(C)c2ccccc12
InChIInChI=1S/C15H15NS/c1-11(15-8-5-9-17-15)13-10-16(2)14-7-4-3-6-12(13)14/h3-11H,1-2H3
InChIKeyUTOOGKMTLBXSHZ-UHFFFAOYSA-N
MW241.36 g/mol
LogP4.39
Rot. Bonds2

About 1-methyl-3-(1-thiophen-2-ylethyl)indole

1-methyl-3-(1-thiophen-2-ylethyl)indole (PubChem CID 23649825) has the molecular formula C15H15NS and a molecular weight of 241.36 g/mol. Its IUPAC name is 1-methyl-3-(1-thiophen-2-ylethyl)indole.

Molecular Properties

Compound Name1-methyl-3-(1-thiophen-2-ylethyl)indole
PubChem CID23649825
Molecular FormulaC15H15NS
Molecular Weight241.36 g/mol
Exact Mass241.09
IUPAC Name1-methyl-3-(1-thiophen-2-ylethyl)indole
SMILESCC(c1cccs1)c1cn(C)c2ccccc12
InChIInChI=1S/C15H15NS/c1-11(15-8-5-9-17-15)13-10-16(2)14-7-4-3-6-12(13)14/h3-11H,1-2H3
InChIKeyUTOOGKMTLBXSHZ-UHFFFAOYSA-N
XLogP4.39
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1-thiophen-2-ylethyl)indole?
The IUPAC name of 1-methyl-3-(1-thiophen-2-ylethyl)indole (CID 23649825) is 1-methyl-3-(1-thiophen-2-ylethyl)indole.
What is the SMILES notation for 1-methyl-3-(1-thiophen-2-ylethyl)indole?
The canonical SMILES for 1-methyl-3-(1-thiophen-2-ylethyl)indole is CC(c1cccs1)c1cn(C)c2ccccc12.
What is the InChIKey of 1-methyl-3-(1-thiophen-2-ylethyl)indole?
The InChIKey is UTOOGKMTLBXSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NS/c1-11(15-8-5-9-17-15)13-10-16(2)14-7-4-3-6-12(13)14/h3-11H,1-2H3.
What are the key properties of 1-methyl-3-(1-thiophen-2-ylethyl)indole?
1-methyl-3-(1-thiophen-2-ylethyl)indole has a molecular weight of 241.36 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1-thiophen-2-ylethyl)indole is sourced from PubChem (CID 23649825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).