1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

C8H8F3N7 — CID 141322298

IUPAC1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESFC(F)(F)c1nc(-c2nn[nH]n2)c2n1CCNC2
InChIInChI=1S/C8H8F3N7/c9-8(10,11)7-13-5(6-14-16-17-15-6)4-3-12-1-2-18(4)7/h12H,1-3H2,(H,14,15,16,17)
InChIKeyBSBMVXOTAZOFKQ-UHFFFAOYSA-N
MW259.19 g/mol
LogP0.19
Rot. Bonds1

About 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (PubChem CID 141322298) has the molecular formula C8H8F3N7 and a molecular weight of 259.19 g/mol. Its IUPAC name is 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
PubChem CID141322298
Molecular FormulaC8H8F3N7
Molecular Weight259.19 g/mol
Exact Mass259.08
IUPAC Name1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESFC(F)(F)c1nc(-c2nn[nH]n2)c2n1CCNC2
InChIInChI=1S/C8H8F3N7/c9-8(10,11)7-13-5(6-14-16-17-15-6)4-3-12-1-2-18(4)7/h12H,1-3H2,(H,14,15,16,17)
InChIKeyBSBMVXOTAZOFKQ-UHFFFAOYSA-N
XLogP0.19
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.19
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Imidazo[1,5-a]pyrazine,5,6,7,8-tetrahydro-1-methyl-3-(trifluoromethyl)-
CID 76849746
2-[1-(difluoromethyl)-2H-triazet-4-yl]-3-methyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
CID 118614077
3-(difluoromethyl)-2-(1-methyl-2H-triazet-4-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
CID 118614448
3-Ethyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
CID 129972703
3-Methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
CID 129972797
9-Butyl-3-methyl-7-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]purine
CID 141192280
3-Methyl-9-pentyl-7-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]purine
CID 141192287
6-Butyl-3-methyl-8-(trifluoromethyl)-5,9-dihydro-[1,2,4]triazolo[3,4-f]purine
CID 141193373
ethane;1-methyl-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-amine
CID 145415886
N,N-dimethyl-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboximidamide
CID 149797648
7-(3,3-difluoropyrrolidin-1-yl)-N-ethyl-2H-triazolo[4,5-d]pyrimidin-5-amine
CID 150173008
3-[3-(2,2-difluoroethyl)-5-methylimidazol-4-yl]-5-methyl-1H-1,2,4-triazole
CID 166698057

Frequently Asked Questions

What is the IUPAC name of 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The IUPAC name of 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (CID 141322298) is 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.
What is the SMILES notation for 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The canonical SMILES for 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is FC(F)(F)c1nc(-c2nn[nH]n2)c2n1CCNC2.
What is the InChIKey of 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The InChIKey is BSBMVXOTAZOFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N7/c9-8(10,11)7-13-5(6-14-16-17-15-6)4-3-12-1-2-18(4)7/h12H,1-3H2,(H,14,15,16,17).
What are the key properties of 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine has a molecular weight of 259.19 g/mol, XLogP of 0.19, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2H-tetrazol-5-yl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is sourced from PubChem (CID 141322298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).