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

C10H9F3N4S — CID 106784328

IUPACN-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine
SMILESCCNc1nccnc1-c1cnc(C(F)(F)F)s1
InChIInChI=1S/C10H9F3N4S/c1-2-14-8-7(15-3-4-16-8)6-5-17-9(18-6)10(11,12)13/h3-5H,2H2,1H3,(H,14,16)
InChIKeySRPFRYPLPWPQMQ-UHFFFAOYSA-N
MW274.27 g/mol
LogP3.05
Rot. Bonds3

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

N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine (PubChem CID 106784328) has the molecular formula C10H9F3N4S and a molecular weight of 274.27 g/mol. Its IUPAC name is N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine
PubChem CID106784328
Molecular FormulaC10H9F3N4S
Molecular Weight274.27 g/mol
Exact Mass274.05
IUPAC NameN-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine
SMILESCCNc1nccnc1-c1cnc(C(F)(F)F)s1
InChIInChI=1S/C10H9F3N4S/c1-2-14-8-7(15-3-4-16-8)6-5-17-9(18-6)10(11,12)13/h3-5H,2H2,1H3,(H,14,16)
InChIKeySRPFRYPLPWPQMQ-UHFFFAOYSA-N
XLogP3.05
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
The IUPAC name of N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine (CID 106784328) is N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine.
What is the SMILES notation for N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
The canonical SMILES for N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine is CCNc1nccnc1-c1cnc(C(F)(F)F)s1.
What is the InChIKey of N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
The InChIKey is SRPFRYPLPWPQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4S/c1-2-14-8-7(15-3-4-16-8)6-5-17-9(18-6)10(11,12)13/h3-5H,2H2,1H3,(H,14,16).
What are the key properties of N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine?
N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine has a molecular weight of 274.27 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazin-2-amine is sourced from PubChem (CID 106784328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).