5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine

C15H10F3N5 — CID 72711836

IUPAC5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine
SMILESNc1ncc(-c2cccnc2)nc1-c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C15H10F3N5/c16-15(17,18)12-4-3-10(7-21-12)13-14(19)22-8-11(23-13)9-2-1-5-20-6-9/h1-8H,(H2,19,22)
InChIKeyUOZDJNGWBNRTNZ-UHFFFAOYSA-N
MW317.27 g/mol
LogP3.20
Rot. Bonds2

About 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine

5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine (PubChem CID 72711836) has the molecular formula C15H10F3N5 and a molecular weight of 317.27 g/mol. Its IUPAC name is 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound Name5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine
PubChem CID72711836
Molecular FormulaC15H10F3N5
Molecular Weight317.27 g/mol
Exact Mass317.09
IUPAC Name5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine
SMILESNc1ncc(-c2cccnc2)nc1-c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C15H10F3N5/c16-15(17,18)12-4-3-10(7-21-12)13-14(19)22-8-11(23-13)9-2-1-5-20-6-9/h1-8H,(H2,19,22)
InChIKeyUOZDJNGWBNRTNZ-UHFFFAOYSA-N
XLogP3.20
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.27
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine?
The IUPAC name of 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine (CID 72711836) is 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine?
The canonical SMILES for 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine is Nc1ncc(-c2cccnc2)nc1-c1ccc(C(F)(F)F)nc1.
What is the InChIKey of 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine?
The InChIKey is UOZDJNGWBNRTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N5/c16-15(17,18)12-4-3-10(7-21-12)13-14(19)22-8-11(23-13)9-2-1-5-20-6-9/h1-8H,(H2,19,22).
What are the key properties of 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine?
5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine has a molecular weight of 317.27 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-3-[6-(trifluoromethyl)-3-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 72711836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).