5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

C13H15N3 — CID 67958777

IUPAC5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESc1ccc(CN2CCn3nccc3C2)cc1
InChIInChI=1S/C13H15N3/c1-2-4-12(5-3-1)10-15-8-9-16-13(11-15)6-7-14-16/h1-7H,8-11H2
InChIKeyPUYBUZILSAMZQT-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.90
Rot. Bonds2

About 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (PubChem CID 67958777) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
PubChem CID67958777
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESc1ccc(CN2CCn3nccc3C2)cc1
InChIInChI=1S/C13H15N3/c1-2-4-12(5-3-1)10-15-8-9-16-13(11-15)6-7-14-16/h1-7H,8-11H2
InChIKeyPUYBUZILSAMZQT-UHFFFAOYSA-N
XLogP1.90
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(6-bromo-3-pyridinyl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 178121670
5-benzyl-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 137452745
2-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)ethanamine
CID 121215304
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
5-benzyl-6-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 162422052
(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine
CID 138466026
5-benzyl-2-(4-bromophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 171367238
dichlorocopper;1,4,7-tribenzyl-1,4,7-triazonane
CID 11307142
(7R)-7-methoxy-5-(2-phenylethyl)-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine
CID 124795614
5-benzyl-2-pyridin-2-yl-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine
CID 122663123
1-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)-2-methylsulfonylethanol
CID 90653864
2,4,6-tris(4-benzylpiperazin-1-yl)-1,3,5-triazine
CID 3393793

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The IUPAC name of 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (CID 67958777) is 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is c1ccc(CN2CCn3nccc3C2)cc1.
What is the InChIKey of 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The InChIKey is PUYBUZILSAMZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-2-4-12(5-3-1)10-15-8-9-16-13(11-15)6-7-14-16/h1-7H,8-11H2.
What are the key properties of 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine has a molecular weight of 213.28 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 67958777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).