1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine

C8H13NO2S2 — CID 107508763

IUPAC1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine
SMILESCOCC(N)CS(=O)c1cccs1
InChIInChI=1S/C8H13NO2S2/c1-11-5-7(9)6-13(10)8-3-2-4-12-8/h2-4,7H,5-6,9H2,1H3
InChIKeyIVTZGNREYICGAO-UHFFFAOYSA-N
MW219.33 g/mol
LogP0.83
Rot. Bonds5

About 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine

1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine (PubChem CID 107508763) has the molecular formula C8H13NO2S2 and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine.

Molecular Properties

Compound Name1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine
PubChem CID107508763
Molecular FormulaC8H13NO2S2
Molecular Weight219.33 g/mol
Exact Mass219.04
IUPAC Name1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine
SMILESCOCC(N)CS(=O)c1cccs1
InChIInChI=1S/C8H13NO2S2/c1-11-5-7(9)6-13(10)8-3-2-4-12-8/h2-4,7H,5-6,9H2,1H3
InChIKeyIVTZGNREYICGAO-UHFFFAOYSA-N
XLogP0.83
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine 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-thiophen-2-ylsulfinylpentan-2-amine
CID 64652798
(2S)-1-methoxy-3-thiophen-2-ylpropan-2-amine
CID 94868216
ethane;(2S)-1-methoxy-3-thiophen-2-ylpropan-2-amine;molecular hydrogen
CID 177035877
1-(2-methoxy-5-methylphenyl)-2-thiophen-2-ylsulfinylethanamine
CID 64652177
1-(3-fluorophenyl)sulfinyl-3-methoxypropan-2-amine
CID 107508854
2-methoxy-1-thiophen-2-ylethanamine
CID 58736274
3-(methylamino)-4-thiophen-2-ylsulfinylbutan-1-ol
CID 64900182
1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine
CID 64651150
2-amino-3-methoxy-N-methyl-N-(thiophen-2-ylmethyl)propanamide
CID 81081754
N-ethyl-3,3-dimethyl-1-thiophen-2-ylsulfinylbutan-2-amine
CID 64653627
1-(oxolan-3-yl)-2-thiophen-2-ylsulfinylethanamine
CID 104754556
2-amino-3-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 120991220

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine?
The IUPAC name of 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine (CID 107508763) is 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine.
What is the SMILES notation for 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine?
The canonical SMILES for 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine is COCC(N)CS(=O)c1cccs1.
What is the InChIKey of 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine?
The InChIKey is IVTZGNREYICGAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2S2/c1-11-5-7(9)6-13(10)8-3-2-4-12-8/h2-4,7H,5-6,9H2,1H3.
What are the key properties of 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine?
1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine has a molecular weight of 219.33 g/mol, XLogP of 0.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine is sourced from PubChem (CID 107508763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).