2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine

C12H11F2NOS — CID 63268980

IUPAC2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine
SMILESNCC(Oc1cc(F)ccc1F)c1ccsc1
InChIInChI=1S/C12H11F2NOS/c13-9-1-2-10(14)11(5-9)16-12(6-15)8-3-4-17-7-8/h1-5,7,12H,6,15H2
InChIKeyOQIOWHDUMVPBTP-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.11
Rot. Bonds4

About 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine

2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine (PubChem CID 63268980) has the molecular formula C12H11F2NOS and a molecular weight of 255.29 g/mol. Its IUPAC name is 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine
PubChem CID63268980
Molecular FormulaC12H11F2NOS
Molecular Weight255.29 g/mol
Exact Mass255.05
IUPAC Name2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine
SMILESNCC(Oc1cc(F)ccc1F)c1ccsc1
InChIInChI=1S/C12H11F2NOS/c13-9-1-2-10(14)11(5-9)16-12(6-15)8-3-4-17-7-8/h1-5,7,12H,6,15H2
InChIKeyOQIOWHDUMVPBTP-UHFFFAOYSA-N
XLogP3.11
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,5-difluorophenoxy)-2-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-(4-bromothiophen-2-yl)-2-(2,5-difluorophenoxy)ethanamine
CID 63269156
2-(4-bromo-3-fluorophenoxy)-2-thiophen-3-ylethanamine
CID 65203482
2-(5-bromo-2-fluorophenoxy)-2-(4-fluorophenyl)ethanamine
CID 114671834
2-(2,5-difluorophenoxy)-2-(5-methylfuran-2-yl)ethanamine
CID 55168512
2-quinolin-5-yloxy-2-thiophen-3-ylethanamine
CID 103044128
[4-(2-amino-1-thiophen-3-ylethoxy)-3-methoxyphenyl]methanol
CID 107742689
2-(2,4-difluorophenoxy)-2-(3-fluorophenyl)ethanamine
CID 55020254
2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine
CID 64854414
3-amino-2-(2,5-difluorophenoxy)propanoic acid
CID 64695247
(S)-(4-fluoro-2-methoxyphenyl)-thiophen-3-ylmethanamine
CID 171205336
(2,5-difluorophenyl)-thiophen-3-ylmethanol
CID 61099759
3-[chloro-(2,5-difluorophenyl)methyl]thiophene
CID 61085350

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine?
The IUPAC name of 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine (CID 63268980) is 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine.
What is the SMILES notation for 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine?
The canonical SMILES for 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine is NCC(Oc1cc(F)ccc1F)c1ccsc1.
What is the InChIKey of 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine?
The InChIKey is OQIOWHDUMVPBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F2NOS/c13-9-1-2-10(14)11(5-9)16-12(6-15)8-3-4-17-7-8/h1-5,7,12H,6,15H2.
What are the key properties of 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine?
2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine has a molecular weight of 255.29 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenoxy)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 63268980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).