6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

C15H17FN2OS — CID 43262722

IUPAC6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCC(C)(C)Oc1nc(Sc2ccc(F)cc2)ccc1N
InChIInChI=1S/C15H17FN2OS/c1-15(2,3)19-14-12(17)8-9-13(18-14)20-11-6-4-10(16)5-7-11/h4-9H,17H2,1-3H3
InChIKeyDZDSWFKKZGLBKI-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.13
Rot. Bonds3

About 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 43262722) has the molecular formula C15H17FN2OS and a molecular weight of 292.38 g/mol. Its IUPAC name is 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID43262722
Molecular FormulaC15H17FN2OS
Molecular Weight292.38 g/mol
Exact Mass292.10
IUPAC Name6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCC(C)(C)Oc1nc(Sc2ccc(F)cc2)ccc1N
InChIInChI=1S/C15H17FN2OS/c1-15(2,3)19-14-12(17)8-9-13(18-14)20-11-6-4-10(16)5-7-11/h4-9H,17H2,1-3H3
InChIKeyDZDSWFKKZGLBKI-UHFFFAOYSA-N
XLogP4.13
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 43262722) is 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is CC(C)(C)Oc1nc(Sc2ccc(F)cc2)ccc1N.
What is the InChIKey of 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is DZDSWFKKZGLBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2OS/c1-15(2,3)19-14-12(17)8-9-13(18-14)20-11-6-4-10(16)5-7-11/h4-9H,17H2,1-3H3.
What are the key properties of 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 292.38 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 43262722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).