2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine

C15H15NOS — CID 104789815

IUPAC2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine
SMILESCc1occc1C(N)Cc1csc2ccccc12
InChIInChI=1S/C15H15NOS/c1-10-12(6-7-17-10)14(16)8-11-9-18-15-5-3-2-4-13(11)15/h2-7,9,14H,8,16H2,1H3
InChIKeyWVQQSGKRPLFOGA-UHFFFAOYSA-N
MW257.36 g/mol
LogP4.05
Rot. Bonds3

About 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine

2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine (PubChem CID 104789815) has the molecular formula C15H15NOS and a molecular weight of 257.36 g/mol. Its IUPAC name is 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine
PubChem CID104789815
Molecular FormulaC15H15NOS
Molecular Weight257.36 g/mol
Exact Mass257.09
IUPAC Name2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine
SMILESCc1occc1C(N)Cc1csc2ccccc12
InChIInChI=1S/C15H15NOS/c1-10-12(6-7-17-10)14(16)8-11-9-18-15-5-3-2-4-13(11)15/h2-7,9,14H,8,16H2,1H3
InChIKeyWVQQSGKRPLFOGA-UHFFFAOYSA-N
XLogP4.05
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine 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

2-(1-benzothiophen-3-yl)-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 104790256
2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethanamine
CID 115823714
2-(1-benzothiophen-3-yl)-1-phenylethanamine
CID 62720010
2-(1-benzothiophen-3-yl)-1-(2,5-dichlorophenyl)ethanamine
CID 115823854
3-[1-benzothiophen-3-yl(bromo)methyl]-2-methylfuran
CID 55199927
2-(4-bromothiophen-2-yl)-1-(2-methylfuran-3-yl)ethanamine
CID 104789820
2-(1-benzothiophen-3-yl)-1-(4-methoxyphenyl)ethanamine
CID 63738834
1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine
CID 63738304
2-(1-benzothiophen-3-yl)-1-(4-chloro-2-methoxyphenyl)ethanamine
CID 115824040
2-(1-benzothiophen-3-yl)-1-(2-methylcyclopropyl)ethanamine
CID 65420177
1-(1-benzothiophen-3-yl)-3-(3-methylphenyl)propan-2-amine
CID 63737079
2-(1-benzothiophen-3-yl)-1-(2,5-dimethylpyrazol-3-yl)ethanamine
CID 105116784

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine?
The IUPAC name of 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine (CID 104789815) is 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine.
What is the SMILES notation for 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine?
The canonical SMILES for 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine is Cc1occc1C(N)Cc1csc2ccccc12.
What is the InChIKey of 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine?
The InChIKey is WVQQSGKRPLFOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NOS/c1-10-12(6-7-17-10)14(16)8-11-9-18-15-5-3-2-4-13(11)15/h2-7,9,14H,8,16H2,1H3.
What are the key properties of 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine?
2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine has a molecular weight of 257.36 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzothiophen-3-yl)-1-(2-methylfuran-3-yl)ethanamine is sourced from PubChem (CID 104789815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).