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4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine

C14H8F4N4S — CID 163268823

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine
SMILESFc1ccc(-c2csc(Nc3cc(C(F)(F)F)ccn3)n2)nc1
InChIInChI=1S/C14H8F4N4S/c15-9-1-2-10(20-6-9)11-7-23-13(21-11)22-12-5-8(3-4-19-12)14(16,17)18/h1-7H,(H,19,21,22)
InChIKeyPJVSAOIAUQGOAA-UHFFFAOYSA-N
MW340.31 g/mol
LogP4.50
Rot. Bonds3

About 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine

4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine (PubChem CID 163268823) has the molecular formula C14H8F4N4S and a molecular weight of 340.31 g/mol. Its IUPAC name is 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine
PubChem CID163268823
Molecular FormulaC14H8F4N4S
Molecular Weight340.31 g/mol
Exact Mass340.04
IUPAC Name4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine
SMILESFc1ccc(-c2csc(Nc3cc(C(F)(F)F)ccn3)n2)nc1
InChIInChI=1S/C14H8F4N4S/c15-9-1-2-10(20-6-9)11-7-23-13(21-11)22-12-5-8(3-4-19-12)14(16,17)18/h1-7H,(H,19,21,22)
InChIKeyPJVSAOIAUQGOAA-UHFFFAOYSA-N
XLogP4.50
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.31
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine (CID 163268823) is 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine is Fc1ccc(-c2csc(Nc3cc(C(F)(F)F)ccn3)n2)nc1.
What is the InChIKey of 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine?
The InChIKey is PJVSAOIAUQGOAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F4N4S/c15-9-1-2-10(20-6-9)11-7-23-13(21-11)22-12-5-8(3-4-19-12)14(16,17)18/h1-7H,(H,19,21,22).
What are the key properties of 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine?
4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine has a molecular weight of 340.31 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-pyridinyl)-N-[4-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 163268823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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