N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine

C11H9F3N6 — CID 80868891

IUPACN-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(-n2cc(C(F)(F)F)cn2)n1
InChIInChI=1S/C11H9F3N6/c1-15-8-6-19-3-2-16-9(19)10(18-8)20-5-7(4-17-20)11(12,13)14/h2-6,15H,1H3
InChIKeySQWXPYKPEGOPSE-UHFFFAOYSA-N
MW282.23 g/mol
LogP1.98
Rot. Bonds2

About N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine

N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80868891) has the molecular formula C11H9F3N6 and a molecular weight of 282.23 g/mol. Its IUPAC name is N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound NameN-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine
PubChem CID80868891
Molecular FormulaC11H9F3N6
Molecular Weight282.23 g/mol
Exact Mass282.08
IUPAC NameN-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(-n2cc(C(F)(F)F)cn2)n1
InChIInChI=1S/C11H9F3N6/c1-15-8-6-19-3-2-16-9(19)10(18-8)20-5-7(4-17-20)11(12,13)14/h2-6,15H,1H3
InChIKeySQWXPYKPEGOPSE-UHFFFAOYSA-N
XLogP1.98
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.23
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine (CID 80868891) is N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine is CNc1cn2ccnc2c(-n2cc(C(F)(F)F)cn2)n1.
What is the InChIKey of N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is SQWXPYKPEGOPSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N6/c1-15-8-6-19-3-2-16-9(19)10(18-8)20-5-7(4-17-20)11(12,13)14/h2-6,15H,1H3.
What are the key properties of N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 282.23 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80868891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).