2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine

C12H14BrNS2 — CID 62602638

IUPAC2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccc(Br)s1)c1ccsc1
InChIInChI=1S/C12H14BrNS2/c1-2-14-11(9-5-6-15-8-9)7-10-3-4-12(13)16-10/h3-6,8,11,14H,2,7H2,1H3
InChIKeyZAOAJWFMOVNQHW-UHFFFAOYSA-N
MW316.29 g/mol
LogP4.47
Rot. Bonds5

About 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine

2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine (PubChem CID 62602638) has the molecular formula C12H14BrNS2 and a molecular weight of 316.29 g/mol. Its IUPAC name is 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine
PubChem CID62602638
Molecular FormulaC12H14BrNS2
Molecular Weight316.29 g/mol
Exact Mass314.98
IUPAC Name2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccc(Br)s1)c1ccsc1
InChIInChI=1S/C12H14BrNS2/c1-2-14-11(9-5-6-15-8-9)7-10-3-4-12(13)16-10/h3-6,8,11,14H,2,7H2,1H3
InChIKeyZAOAJWFMOVNQHW-UHFFFAOYSA-N
XLogP4.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.29
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine 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-(5-bromothiophen-2-yl)-N-ethyl-1-(4-methylphenyl)ethanamine
CID 62600711
2-(4-bromophenyl)-N-ethyl-1-thiophen-3-ylethanamine
CID 60818853
2-(5-bromothiophen-2-yl)-1-(3-chlorothiophen-2-yl)-N-ethylethanamine
CID 115841258
2-(5-bromothiophen-2-yl)-1-(3-chloro-4-methylphenyl)-N-ethylethanamine
CID 115841239
2-(4-bromo-2-fluorophenyl)-N-ethyl-1-thiophen-3-ylethanamine
CID 55095736
2-(5-bromo-2-fluorophenyl)-N-ethyl-1-thiophen-3-ylethanamine
CID 55095689
2-(5-bromothiophen-2-yl)-1-(2,5-dichlorothiophen-3-yl)-N-ethylethanamine
CID 114022092
2-(5-bromothiophen-2-yl)-N-ethyl-1-quinolin-6-ylethanamine
CID 63097218
2-(5-bromothiophen-2-yl)-1-(2-chloro-3-methylphenyl)-N-ethylethanamine
CID 115841070
N-ethyl-1-thiophen-3-ylbut-3-en-1-amine
CID 61380819
2-(5-bromothiophen-2-yl)-N-ethyl-1-(5-fluoro-2-pyridinyl)ethanamine
CID 79723631
1-(5-bromothiophen-2-yl)-N-ethyl-4,4-dimethylpentan-2-amine
CID 63891302

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine?
The IUPAC name of 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine (CID 62602638) is 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine.
What is the SMILES notation for 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine?
The canonical SMILES for 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine is CCNC(Cc1ccc(Br)s1)c1ccsc1.
What is the InChIKey of 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine?
The InChIKey is ZAOAJWFMOVNQHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrNS2/c1-2-14-11(9-5-6-15-8-9)7-10-3-4-12(13)16-10/h3-6,8,11,14H,2,7H2,1H3.
What are the key properties of 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine?
2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine has a molecular weight of 316.29 g/mol, XLogP of 4.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromothiophen-2-yl)-N-ethyl-1-thiophen-3-ylethanamine is sourced from PubChem (CID 62602638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).