N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine

C13H17NOS — CID 83182960

IUPACN-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine
SMILESCCNC(Cc1ccco1)c1cscc1C
InChIInChI=1S/C13H17NOS/c1-3-14-13(7-11-5-4-6-15-11)12-9-16-8-10(12)2/h4-6,8-9,13-14H,3,7H2,1-2H3
InChIKeyADNXMAGXIGTDEM-UHFFFAOYSA-N
MW235.35 g/mol
LogP3.54
Rot. Bonds5

About N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine

N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine (PubChem CID 83182960) has the molecular formula C13H17NOS and a molecular weight of 235.35 g/mol. Its IUPAC name is N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine
PubChem CID83182960
Molecular FormulaC13H17NOS
Molecular Weight235.35 g/mol
Exact Mass235.10
IUPAC NameN-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine
SMILESCCNC(Cc1ccco1)c1cscc1C
InChIInChI=1S/C13H17NOS/c1-3-14-13(7-11-5-4-6-15-11)12-9-16-8-10(12)2/h4-6,8-9,13-14H,3,7H2,1-2H3
InChIKeyADNXMAGXIGTDEM-UHFFFAOYSA-N
XLogP3.54
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-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-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanol
CID 83175177
N-ethyl-2-(furan-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
CID 83176213
1-(2-chloro-3-fluorophenyl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 105029261
1-(3-chloro-2-fluorophenyl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 83176044
N-ethyl-2-(furan-2-yl)-1-pyridin-4-ylethanamine
CID 83175492
N-ethyl-2-(furan-2-yl)-1-(4-methoxy-3-methylphenyl)ethanamine
CID 83183271
N-ethyl-1-[5-fluoro-2-(trifluoromethyl)phenyl]-2-(furan-2-yl)ethanamine
CID 83178417
N-ethyl-2-(5-fluoro-2-methylphenyl)-1-(4-methylthiophen-3-yl)ethanamine
CID 105374183
1-(2-bromo-5-methoxyphenyl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 105177265
N-[1-(2-bromo-3-methylphenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 107985335
N-[1-(4-bromo-2-methylphenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 105029326
N-ethyl-2-(3-methoxyphenyl)-1-(4-methylthiophen-3-yl)ethanamine
CID 79802298

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine?
The IUPAC name of N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine (CID 83182960) is N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine is CCNC(Cc1ccco1)c1cscc1C.
What is the InChIKey of N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine?
The InChIKey is ADNXMAGXIGTDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NOS/c1-3-14-13(7-11-5-4-6-15-11)12-9-16-8-10(12)2/h4-6,8-9,13-14H,3,7H2,1-2H3.
What are the key properties of N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine?
N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine has a molecular weight of 235.35 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(furan-2-yl)-1-(4-methylthiophen-3-yl)ethanamine is sourced from PubChem (CID 83182960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).