1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine

C14H15NOS — CID 105177243

IUPAC1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine
SMILESNC(Cc1ccco1)C1Cc2ccccc2S1
InChIInChI=1S/C14H15NOS/c15-12(9-11-5-3-7-16-11)14-8-10-4-1-2-6-13(10)17-14/h1-7,12,14H,8-9,15H2
InChIKeyXOTAUEQOLOOVBN-UHFFFAOYSA-N
MW245.35 g/mol
LogP2.87
Rot. Bonds3

About 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine

1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine (PubChem CID 105177243) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine
PubChem CID105177243
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC Name1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine
SMILESNC(Cc1ccco1)C1Cc2ccccc2S1
InChIInChI=1S/C14H15NOS/c15-12(9-11-5-3-7-16-11)14-8-10-4-1-2-6-13(10)17-14/h1-7,12,14H,8-9,15H2
InChIKeyXOTAUEQOLOOVBN-UHFFFAOYSA-N
XLogP2.87
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-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

1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanamine
CID 105169029
2-(2,3-difluorophenyl)-1-(2,3-dihydro-1-benzothiophen-2-yl)ethanamine
CID 105137669
2-(3-bromo-4-fluorophenyl)-1-(2,3-dihydro-1-benzothiophen-2-yl)ethanamine
CID 105111246
1-(2,3-dihydro-1-benzothiophen-2-yl)hex-5-en-1-amine
CID 105152981
2-(2,3-dihydro-1-benzothiophen-2-ylmethylsulfanylmethyl)furan
CID 79326430
1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(2-ethyl-5-methylpyrazol-3-yl)ethanamine
CID 105162301
1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 105121936
1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethanamine
CID 105160076
N-(furan-2-ylmethyl)-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 18134735
2-(furan-2-yl)-1-(oxan-4-yl)ethanamine
CID 83175646
[1-(2,3-dihydro-1-benzothiophen-2-yl)-2-pyridin-4-ylethyl]hydrazine
CID 105317497
[1-(2,3-dihydro-1-benzothiophen-2-yl)-2-methoxyethyl]hydrazine
CID 105321616

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine?
The IUPAC name of 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine (CID 105177243) is 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine is NC(Cc1ccco1)C1Cc2ccccc2S1.
What is the InChIKey of 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine?
The InChIKey is XOTAUEQOLOOVBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS/c15-12(9-11-5-3-7-16-11)14-8-10-4-1-2-6-13(10)17-14/h1-7,12,14H,8-9,15H2.
What are the key properties of 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine?
1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine has a molecular weight of 245.35 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 105177243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).