2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine

C12H14N2OS2 — CID 43262850

IUPAC2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine
SMILESCCCOc1nc(Sc2cccs2)ccc1N
InChIInChI=1S/C12H14N2OS2/c1-2-7-15-12-9(13)5-6-10(14-12)17-11-4-3-8-16-11/h3-6,8H,2,7,13H2,1H3
InChIKeyIZXAPVIYVHTUGC-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.67
Rot. Bonds5

About 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine

2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine (PubChem CID 43262850) has the molecular formula C12H14N2OS2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine.

Molecular Properties

Compound Name2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine
PubChem CID43262850
Molecular FormulaC12H14N2OS2
Molecular Weight266.39 g/mol
Exact Mass266.05
IUPAC Name2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine
SMILESCCCOc1nc(Sc2cccs2)ccc1N
InChIInChI=1S/C12H14N2OS2/c1-2-7-15-12-9(13)5-6-10(14-12)17-11-4-3-8-16-11/h3-6,8H,2,7,13H2,1H3
InChIKeyIZXAPVIYVHTUGC-UHFFFAOYSA-N
XLogP3.67
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine?
The IUPAC name of 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine (CID 43262850) is 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine.
What is the SMILES notation for 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine?
The canonical SMILES for 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine is CCCOc1nc(Sc2cccs2)ccc1N.
What is the InChIKey of 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine?
The InChIKey is IZXAPVIYVHTUGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS2/c1-2-7-15-12-9(13)5-6-10(14-12)17-11-4-3-8-16-11/h3-6,8H,2,7,13H2,1H3.
What are the key properties of 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine?
2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine has a molecular weight of 266.39 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propoxy-6-thiophen-2-ylsulfanylpyridin-3-amine is sourced from PubChem (CID 43262850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).