[1-(2-thiophen-2-ylethyl)indol-5-yl]methanol

C15H15NOS — CID 102912527

IUPAC[1-(2-thiophen-2-ylethyl)indol-5-yl]methanol
SMILESOCc1ccc2c(ccn2CCc2cccs2)c1
InChIInChI=1S/C15H15NOS/c17-11-12-3-4-15-13(10-12)5-7-16(15)8-6-14-2-1-9-18-14/h1-5,7,9-10,17H,6,8,11H2
InChIKeyMUCCHUGQYJJPAD-UHFFFAOYSA-N
MW257.36 g/mol
LogP3.44
Rot. Bonds4

About [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol

[1-(2-thiophen-2-ylethyl)indol-5-yl]methanol (PubChem CID 102912527) has the molecular formula C15H15NOS and a molecular weight of 257.36 g/mol. Its IUPAC name is [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol.

Molecular Properties

Compound Name[1-(2-thiophen-2-ylethyl)indol-5-yl]methanol
PubChem CID102912527
Molecular FormulaC15H15NOS
Molecular Weight257.36 g/mol
Exact Mass257.09
IUPAC Name[1-(2-thiophen-2-ylethyl)indol-5-yl]methanol
SMILESOCc1ccc2c(ccn2CCc2cccs2)c1
InChIInChI=1S/C15H15NOS/c17-11-12-3-4-15-13(10-12)5-7-16(15)8-6-14-2-1-9-18-14/h1-5,7,9-10,17H,6,8,11H2
InChIKeyMUCCHUGQYJJPAD-UHFFFAOYSA-N
XLogP3.44
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-thiophen-2-ylethyl)indole-5-carboxylic acid
CID 63775889
1-[1-(2-thiophen-2-ylethyl)indol-5-yl]butan-2-amine
CID 102917638
5-nitro-1-(2-thiophen-2-ylethyl)indole
CID 116619096
(1-butylindol-5-yl)methanol
CID 102912394
[1-[2-(dimethylamino)ethyl]indol-5-yl]methanol
CID 102912856
1-[1-(2-thiophen-2-ylethyl)indol-6-yl]butan-2-amine
CID 102917962
N-[2-(5-chloroindol-1-yl)ethyl]-2-thiophen-2-ylethanamine
CID 63879905
[1-(4-methoxybutyl)indol-5-yl]methanol
CID 102912647
2-[5-(hydroxymethyl)indol-1-yl]-N,N-dimethylacetamide
CID 102912783
4-[[5-(hydroxymethyl)indol-1-yl]methyl]benzoic acid
CID 102912731
[1-[(E)-but-2-enyl]indol-5-yl]methanol
CID 102912660
1-[1-(2-thiophen-2-ylethyl)pyrrol-2-yl]ethanone
CID 79106807

Frequently Asked Questions

What is the IUPAC name of [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol?
The IUPAC name of [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol (CID 102912527) is [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol.
What is the SMILES notation for [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol?
The canonical SMILES for [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol is OCc1ccc2c(ccn2CCc2cccs2)c1.
What is the InChIKey of [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol?
The InChIKey is MUCCHUGQYJJPAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NOS/c17-11-12-3-4-15-13(10-12)5-7-16(15)8-6-14-2-1-9-18-14/h1-5,7,9-10,17H,6,8,11H2.
What are the key properties of [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol?
[1-(2-thiophen-2-ylethyl)indol-5-yl]methanol has a molecular weight of 257.36 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-thiophen-2-ylethyl)indol-5-yl]methanol is sourced from PubChem (CID 102912527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).