6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine

C15H17FN2OS — CID 43262723

IUPAC6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine
SMILESCC(C)COc1nc(Sc2ccc(F)cc2)ccc1N
InChIInChI=1S/C15H17FN2OS/c1-10(2)9-19-15-13(17)7-8-14(18-15)20-12-5-3-11(16)4-6-12/h3-8,10H,9,17H2,1-2H3
InChIKeyQVWGDIPLFAQKMI-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.99
Rot. Bonds5

About 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine

6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine (PubChem CID 43262723) has the molecular formula C15H17FN2OS and a molecular weight of 292.38 g/mol. Its IUPAC name is 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine
PubChem CID43262723
Molecular FormulaC15H17FN2OS
Molecular Weight292.38 g/mol
Exact Mass292.10
IUPAC Name6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine
SMILESCC(C)COc1nc(Sc2ccc(F)cc2)ccc1N
InChIInChI=1S/C15H17FN2OS/c1-10(2)9-19-15-13(17)7-8-14(18-15)20-12-5-3-11(16)4-6-12/h3-8,10H,9,17H2,1-2H3
InChIKeyQVWGDIPLFAQKMI-UHFFFAOYSA-N
XLogP3.99
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.99
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-methylpropoxy)pyridin-3-amine?
The IUPAC name of 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine (CID 43262723) is 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine.
What is the SMILES notation for 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine?
The canonical SMILES for 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine is CC(C)COc1nc(Sc2ccc(F)cc2)ccc1N.
What is the InChIKey of 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine?
The InChIKey is QVWGDIPLFAQKMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2OS/c1-10(2)9-19-15-13(17)7-8-14(18-15)20-12-5-3-11(16)4-6-12/h3-8,10H,9,17H2,1-2H3.
What are the key properties of 6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine?
6-(4-fluorophenyl)sulfanyl-2-(2-methylpropoxy)pyridin-3-amine has a molecular weight of 292.38 g/mol, XLogP of 3.99, 5 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-methylpropoxy)pyridin-3-amine is sourced from PubChem (CID 43262723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).