6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine

C17H19F2N7O — CID 75075646

IUPAC6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine
SMILESFC(F)COc1cn2ncc(-c3cncc(NC4CCCNC4)n3)c2cn1
InChIInChI=1S/C17H19F2N7O/c18-15(19)10-27-17-9-26-14(7-22-17)12(5-23-26)13-6-21-8-16(25-13)24-11-2-1-3-20-4-11/h5-9,11,15,20H,1-4,10H2,(H,24,25)
InChIKeyLFARIZKCECWCCD-UHFFFAOYSA-N
MW375.38 g/mol
LogP1.99
Rot. Bonds6

About 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine

6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine (PubChem CID 75075646) has the molecular formula C17H19F2N7O and a molecular weight of 375.38 g/mol. Its IUPAC name is 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine
PubChem CID75075646
Molecular FormulaC17H19F2N7O
Molecular Weight375.38 g/mol
Exact Mass375.16
IUPAC Name6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine
SMILESFC(F)COc1cn2ncc(-c3cncc(NC4CCCNC4)n3)c2cn1
InChIInChI=1S/C17H19F2N7O/c18-15(19)10-27-17-9-26-14(7-22-17)12(5-23-26)13-6-21-8-16(25-13)24-11-2-1-3-20-4-11/h5-9,11,15,20H,1-4,10H2,(H,24,25)
InChIKeyLFARIZKCECWCCD-UHFFFAOYSA-N
XLogP1.99
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.38
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine?
The IUPAC name of 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine (CID 75075646) is 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine.
What is the SMILES notation for 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine?
The canonical SMILES for 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine is FC(F)COc1cn2ncc(-c3cncc(NC4CCCNC4)n3)c2cn1.
What is the InChIKey of 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine?
The InChIKey is LFARIZKCECWCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F2N7O/c18-15(19)10-27-17-9-26-14(7-22-17)12(5-23-26)13-6-21-8-16(25-13)24-11-2-1-3-20-4-11/h5-9,11,15,20H,1-4,10H2,(H,24,25).
What are the key properties of 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine?
6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine has a molecular weight of 375.38 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(2,2-difluoroethoxy)pyrazolo[1,5-a]pyrazin-3-yl]-N-piperidin-3-ylpyrazin-2-amine is sourced from PubChem (CID 75075646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).