N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine

C9H7F3N4S — CID 106784388

IUPACN-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine
SMILESCNc1cncc(-c2cnc(C(F)(F)F)s2)n1
InChIInChI=1S/C9H7F3N4S/c1-13-7-4-14-2-5(16-7)6-3-15-8(17-6)9(10,11)12/h2-4H,1H3,(H,13,16)
InChIKeyMOTOLRLVFOOIIS-UHFFFAOYSA-N
MW260.24 g/mol
LogP2.66
Rot. Bonds2

About N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine

N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine (PubChem CID 106784388) has the molecular formula C9H7F3N4S and a molecular weight of 260.24 g/mol. Its IUPAC name is N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine
PubChem CID106784388
Molecular FormulaC9H7F3N4S
Molecular Weight260.24 g/mol
Exact Mass260.03
IUPAC NameN-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine
SMILESCNc1cncc(-c2cnc(C(F)(F)F)s2)n1
InChIInChI=1S/C9H7F3N4S/c1-13-7-4-14-2-5(16-7)6-3-15-8(17-6)9(10,11)12/h2-4H,1H3,(H,13,16)
InChIKeyMOTOLRLVFOOIIS-UHFFFAOYSA-N
XLogP2.66
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.24
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
The IUPAC name of N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine (CID 106784388) is N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
The canonical SMILES for N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine is CNc1cncc(-c2cnc(C(F)(F)F)s2)n1.
What is the InChIKey of N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
The InChIKey is MOTOLRLVFOOIIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N4S/c1-13-7-4-14-2-5(16-7)6-3-15-8(17-6)9(10,11)12/h2-4H,1H3,(H,13,16).
What are the key properties of N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine has a molecular weight of 260.24 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine is sourced from PubChem (CID 106784388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).