4-ethoxy-1-(2-thiophen-3-ylethyl)indole

C16H17NOS — CID 83173883

IUPAC4-ethoxy-1-(2-thiophen-3-ylethyl)indole
SMILESCCOc1cccc2c1ccn2CCc1ccsc1
InChIInChI=1S/C16H17NOS/c1-2-18-16-5-3-4-15-14(16)7-10-17(15)9-6-13-8-11-19-12-13/h3-5,7-8,10-12H,2,6,9H2,1H3
InChIKeyXUUMUAZSTZZSQX-UHFFFAOYSA-N
MW271.39 g/mol
LogP4.34
Rot. Bonds5

About 4-ethoxy-1-(2-thiophen-3-ylethyl)indole

4-ethoxy-1-(2-thiophen-3-ylethyl)indole (PubChem CID 83173883) has the molecular formula C16H17NOS and a molecular weight of 271.39 g/mol. Its IUPAC name is 4-ethoxy-1-(2-thiophen-3-ylethyl)indole.

Molecular Properties

Compound Name4-ethoxy-1-(2-thiophen-3-ylethyl)indole
PubChem CID83173883
Molecular FormulaC16H17NOS
Molecular Weight271.39 g/mol
Exact Mass271.10
IUPAC Name4-ethoxy-1-(2-thiophen-3-ylethyl)indole
SMILESCCOc1cccc2c1ccn2CCc1ccsc1
InChIInChI=1S/C16H17NOS/c1-2-18-16-5-3-4-15-14(16)7-10-17(15)9-6-13-8-11-19-12-13/h3-5,7-8,10-12H,2,6,9H2,1H3
InChIKeyXUUMUAZSTZZSQX-UHFFFAOYSA-N
XLogP4.34
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-ethoxy-1-(2-thiophen-3-ylethyl)indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-propan-2-yloxy-1-(2-thiophen-3-ylethyl)indole
CID 83163450
2-(4-ethoxyindol-1-yl)ethanol
CID 83174332
5-(4-ethoxyindol-1-yl)pentan-2-one
CID 83163108
4-ethoxy-1-(2-pyrrolidin-1-ylethyl)indole
CID 83173234
2-(4-ethoxyindol-1-yl)acetic acid
CID 83162473
4-ethoxy-1-(phenylmethoxymethyl)indole
CID 102940706
4-(4-ethoxyindol-1-yl)-2,2-dimethylbutanoic acid
CID 83162756
N-[2-(4-ethoxyindol-1-yl)ethyl]pentan-3-amine
CID 83162426
1-(cyclopropylmethyl)-4-ethoxyindole
CID 83173607
4-ethoxy-1-(2-methylbutyl)indole
CID 83173509
2-(4-ethoxyindol-1-yl)-N,N-diethylacetamide
CID 83174508
4-ethoxy-1-[(5-ethylthiophen-2-yl)methyl]indole
CID 83173603

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-1-(2-thiophen-3-ylethyl)indole?
The IUPAC name of 4-ethoxy-1-(2-thiophen-3-ylethyl)indole (CID 83173883) is 4-ethoxy-1-(2-thiophen-3-ylethyl)indole.
What is the SMILES notation for 4-ethoxy-1-(2-thiophen-3-ylethyl)indole?
The canonical SMILES for 4-ethoxy-1-(2-thiophen-3-ylethyl)indole is CCOc1cccc2c1ccn2CCc1ccsc1.
What is the InChIKey of 4-ethoxy-1-(2-thiophen-3-ylethyl)indole?
The InChIKey is XUUMUAZSTZZSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NOS/c1-2-18-16-5-3-4-15-14(16)7-10-17(15)9-6-13-8-11-19-12-13/h3-5,7-8,10-12H,2,6,9H2,1H3.
What are the key properties of 4-ethoxy-1-(2-thiophen-3-ylethyl)indole?
4-ethoxy-1-(2-thiophen-3-ylethyl)indole has a molecular weight of 271.39 g/mol, XLogP of 4.34, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-1-(2-thiophen-3-ylethyl)indole is sourced from PubChem (CID 83173883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).