5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

C17H18N4O2 — CID 131642230

IUPAC5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESc1cncc(OCC2CN(Cc3ccoc3)Cc3ccnn32)c1
InChIInChI=1S/C17H18N4O2/c1-2-17(8-18-5-1)23-13-16-11-20(9-14-4-7-22-12-14)10-15-3-6-19-21(15)16/h1-8,12,16H,9-11,13H2
InChIKeyPEJLDMWTNCFPTA-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.51
Rot. Bonds5

About 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (PubChem CID 131642230) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
PubChem CID131642230
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESc1cncc(OCC2CN(Cc3ccoc3)Cc3ccnn32)c1
InChIInChI=1S/C17H18N4O2/c1-2-17(8-18-5-1)23-13-16-11-20(9-14-4-7-22-12-14)10-15-3-6-19-21(15)16/h1-8,12,16H,9-11,13H2
InChIKeyPEJLDMWTNCFPTA-UHFFFAOYSA-N
XLogP2.51
TPSA56.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(7R)-5-(furan-3-ylmethyl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 124790479
5-(furan-3-ylmethyl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 131652106
5-(2-phenylmethoxyethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 133137057
N-[2-[(7S)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]pyridine-3-carboxamide
CID 124781266
3-(furan-3-ylmethoxy)pyridine
CID 112558860
(5R)-7-(furan-3-ylmethyl)-5-(pyridin-2-yloxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 124803021
3-[2-[5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]-1,1-dimethylurea
CID 131660122
N-methyl-2-[5-(pyridin-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131677523
5-(pyridin-2-ylmethyl)-7-(pyridin-2-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 131678215
(4R,5S)-7-(furan-3-ylmethyl)-4-(pyridin-3-yloxymethyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 97485283
N-[[5-(furan-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]pyrrolidine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155866383
(7S)-5-cyclopentyl-7-(2-pyridin-3-yloxyethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 124909674

Frequently Asked Questions

What is the IUPAC name of 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The IUPAC name of 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (CID 131642230) is 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is c1cncc(OCC2CN(Cc3ccoc3)Cc3ccnn32)c1.
What is the InChIKey of 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The InChIKey is PEJLDMWTNCFPTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-2-17(8-18-5-1)23-13-16-11-20(9-14-4-7-22-12-14)10-15-3-6-19-21(15)16/h1-8,12,16H,9-11,13H2.
What are the key properties of 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine has a molecular weight of 310.36 g/mol, XLogP of 2.51, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-3-ylmethyl)-7-(pyridin-3-yloxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 131642230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).