2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine

C11H8F6N4 — CID 106215074

IUPAC2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESFC(F)(F)c1cc2c(NC3(C(F)(F)F)CC3)nccn2n1
InChIInChI=1S/C11H8F6N4/c12-10(13,14)7-5-6-8(18-3-4-21(6)20-7)19-9(1-2-9)11(15,16)17/h3-5H,1-2H2,(H,18,19)
InChIKeyPEBGKIVRUHYSMB-UHFFFAOYSA-N
MW310.20 g/mol
LogP3.25
Rot. Bonds2

About 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine

2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 106215074) has the molecular formula C11H8F6N4 and a molecular weight of 310.20 g/mol. Its IUPAC name is 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound Name2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID106215074
Molecular FormulaC11H8F6N4
Molecular Weight310.20 g/mol
Exact Mass310.07
IUPAC Name2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESFC(F)(F)c1cc2c(NC3(C(F)(F)F)CC3)nccn2n1
InChIInChI=1S/C11H8F6N4/c12-10(13,14)7-5-6-8(18-3-4-21(6)20-7)19-9(1-2-9)11(15,16)17/h3-5H,1-2H2,(H,18,19)
InChIKeyPEBGKIVRUHYSMB-UHFFFAOYSA-N
XLogP3.25
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.20
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]amino]cyclobutane-1-carboxylic acid
CID 104729723
N-(2,2-dimethylpropyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730934
N-cyclopentyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730383
3-[[[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]amino]methyl]cyclobutan-1-ol
CID 104731784
N-(4-methoxybutyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731181
1-N-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]cyclobutane-1,3-diamine
CID 104732329
N-(4-methylcyclohexyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730545
N-(5-methylhexyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731951
N-[(3-chlorocyclobutyl)methyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104734009
1-N-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]cyclopentane-1,2-diamine
CID 104732485
N-(1H-pyrazol-4-ylmethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730831
2-N-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]cyclohexane-1,2-diamine
CID 104732368

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine (CID 106215074) is 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine is FC(F)(F)c1cc2c(NC3(C(F)(F)F)CC3)nccn2n1.
What is the InChIKey of 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is PEBGKIVRUHYSMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F6N4/c12-10(13,14)7-5-6-8(18-3-4-21(6)20-7)19-9(1-2-9)11(15,16)17/h3-5H,1-2H2,(H,18,19).
What are the key properties of 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine?
2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 310.20 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-N-[1-(trifluoromethyl)cyclopropyl]pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 106215074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).