2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane

C8H12F3N3 — CID 112757182

IUPAC2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane
SMILESCF.FC(F)c1cn2c(n1)CNCC2
InChIInChI=1S/C7H9F2N3.CH3F/c8-7(9)5-4-12-2-1-10-3-6(12)11-5;1-2/h4,7,10H,1-3H2;1H3
InChIKeyCQXSQROCOZTPJB-UHFFFAOYSA-N
MW207.20 g/mol
LogP1.51
Rot. Bonds1

About 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane

2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane (PubChem CID 112757182) has the molecular formula C8H12F3N3 and a molecular weight of 207.20 g/mol. Its IUPAC name is 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane.

Molecular Properties

Compound Name2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane
PubChem CID112757182
Molecular FormulaC8H12F3N3
Molecular Weight207.20 g/mol
Exact Mass207.10
IUPAC Name2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane
SMILESCF.FC(F)c1cn2c(n1)CNCC2
InChIInChI=1S/C7H9F2N3.CH3F/c8-7(9)5-4-12-2-1-10-3-6(12)11-5;1-2/h4,7,10H,1-3H2;1H3
InChIKeyCQXSQROCOZTPJB-UHFFFAOYSA-N
XLogP1.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane?
The IUPAC name of 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane (CID 112757182) is 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane.
What is the SMILES notation for 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane?
The canonical SMILES for 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane is CF.FC(F)c1cn2c(n1)CNCC2.
What is the InChIKey of 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane?
The InChIKey is CQXSQROCOZTPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F2N3.CH3F/c8-7(9)5-4-12-2-1-10-3-6(12)11-5;1-2/h4,7,10H,1-3H2;1H3.
What are the key properties of 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane?
2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane has a molecular weight of 207.20 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane is sourced from PubChem (CID 112757182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).