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

C18H15NOS — CID 63738304

IUPAC1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine
SMILESNC(Cc1csc2ccccc12)c1cc2ccccc2o1
InChIInChI=1S/C18H15NOS/c19-15(17-10-12-5-1-3-7-16(12)20-17)9-13-11-21-18-8-4-2-6-14(13)18/h1-8,10-11,15H,9,19H2
InChIKeyPANHPAGNZXVQSN-UHFFFAOYSA-N
MW293.39 g/mol
LogP4.89
Rot. Bonds3

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

1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine (PubChem CID 63738304) has the molecular formula C18H15NOS and a molecular weight of 293.39 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine
PubChem CID63738304
Molecular FormulaC18H15NOS
Molecular Weight293.39 g/mol
Exact Mass293.09
IUPAC Name1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine
SMILESNC(Cc1csc2ccccc12)c1cc2ccccc2o1
InChIInChI=1S/C18H15NOS/c19-15(17-10-12-5-1-3-7-16(12)20-17)9-13-11-21-18-8-4-2-6-14(13)18/h1-8,10-11,15H,9,19H2
InChIKeyPANHPAGNZXVQSN-UHFFFAOYSA-N
XLogP4.89
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-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)-1-phenylethanamine
CID 62720010
2-(1-benzothiophen-3-yl)-1-(3,4,5-trifluorophenyl)ethanamine
CID 63736733
2-(1-benzothiophen-3-yl)-1-(4-methoxyphenyl)ethanamine
CID 63738834
2-(1-benzothiophen-3-yl)-1-(2,5-dichlorophenyl)ethanamine
CID 115823854
3-(1-benzothiophen-3-yl)-2-phenylpropan-1-amine
CID 65429469
2-amino-3-(1-benzothiophen-3-yl)propanal
CID 23504453
2-amino-2-(1-benzofuran-2-yl)ethanol
CID 54265707
2-(1-benzothiophen-3-yl)-1-(2,5-dimethylpyrazol-3-yl)ethanamine
CID 105116784
1-(1-benzothiophen-3-yl)-3-(2,6-dichlorophenyl)propan-2-amine
CID 63737420
2-(1-benzothiophen-3-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanamine
CID 115823598
3-(1-benzothiophen-3-ylmethyl)pentan-2-amine
CID 63738810
2-(1-benzothiophen-3-yl)-1-(oxolan-3-yl)ethanamine
CID 65330130

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine (CID 63738304) is 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine is NC(Cc1csc2ccccc12)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine?
The InChIKey is PANHPAGNZXVQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NOS/c19-15(17-10-12-5-1-3-7-16(12)20-17)9-13-11-21-18-8-4-2-6-14(13)18/h1-8,10-11,15H,9,19H2.
What are the key properties of 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine?
1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine has a molecular weight of 293.39 g/mol, XLogP of 4.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-(1-benzothiophen-3-yl)ethanamine is sourced from PubChem (CID 63738304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).