2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine

C13H13FN2OS — CID 43262694

IUPAC2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine
SMILESCCOc1nc(Sc2ccccc2F)ccc1N
InChIInChI=1S/C13H13FN2OS/c1-2-17-13-10(15)7-8-12(16-13)18-11-6-4-3-5-9(11)14/h3-8H,2,15H2,1H3
InChIKeyPJZYCZOBMXZBIT-UHFFFAOYSA-N
MW264.32 g/mol
LogP3.35
Rot. Bonds4

About 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine

2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine (PubChem CID 43262694) has the molecular formula C13H13FN2OS and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine
PubChem CID43262694
Molecular FormulaC13H13FN2OS
Molecular Weight264.32 g/mol
Exact Mass264.07
IUPAC Name2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine
SMILESCCOc1nc(Sc2ccccc2F)ccc1N
InChIInChI=1S/C13H13FN2OS/c1-2-17-13-10(15)7-8-12(16-13)18-11-6-4-3-5-9(11)14/h3-8H,2,15H2,1H3
InChIKeyPJZYCZOBMXZBIT-UHFFFAOYSA-N
XLogP3.35
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine?
The IUPAC name of 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine (CID 43262694) is 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine.
What is the SMILES notation for 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine?
The canonical SMILES for 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine is CCOc1nc(Sc2ccccc2F)ccc1N.
What is the InChIKey of 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine?
The InChIKey is PJZYCZOBMXZBIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2OS/c1-2-17-13-10(15)7-8-12(16-13)18-11-6-4-3-5-9(11)14/h3-8H,2,15H2,1H3.
What are the key properties of 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine?
2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine has a molecular weight of 264.32 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6-(2-fluorophenyl)sulfanylpyridin-3-amine is sourced from PubChem (CID 43262694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).