(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine

C14H18N4 — CID 138466026

IUPAC(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine
SMILESNCc1cnn2c1CN(Cc1ccccc1)CC2
InChIInChI=1S/C14H18N4/c15-8-13-9-16-18-7-6-17(11-14(13)18)10-12-4-2-1-3-5-12/h1-5,9H,6-8,10-11,15H2
InChIKeyUAJBTAIXABUPCW-UHFFFAOYSA-N
MW242.33 g/mol
LogP1.36
Rot. Bonds3

About (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine

(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine (PubChem CID 138466026) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine.

Molecular Properties

Compound Name(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine
PubChem CID138466026
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine
SMILESNCc1cnn2c1CN(Cc1ccccc1)CC2
InChIInChI=1S/C14H18N4/c15-8-13-9-16-18-7-6-17(11-14(13)18)10-12-4-2-1-3-5-12/h1-5,9H,6-8,10-11,15H2
InChIKeyUAJBTAIXABUPCW-UHFFFAOYSA-N
XLogP1.36
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

benzyl 2-(3-ethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)acetate
CID 169194253
5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 67958777
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
3-(7-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)propan-1-amine
CID 82379207
N-[(E)-[2-amino-1-[5-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)-2-methylphenyl]ethylidene]amino]formamide
CID 166161453
[3-(4-benzylpiperazin-1-yl)pyridazin-4-yl]methanamine
CID 80505607
(4E)-4-(1-benzylpiperidin-3-ylidene)butan-1-amine
CID 70159543
5-benzyl-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 137452745
3,7,11-tribenzyl-3,7,11-triazabicyclo[11.2.2]heptadeca-1(15),13,16-triene
CID 101181237
1-benzylazepane
CID 10954328
dichlorocopper;1,4,7-tribenzyl-1,4,7-triazonane
CID 11307142
2-(aminomethyl)-6-[[1-[[3-(aminomethyl)-2-hydroxy-5-methylphenyl]methyl]-4-benzyl-1,4,8-triazacycloundec-8-yl]methyl]-4-methylphenol
CID 170744267

Frequently Asked Questions

What is the IUPAC name of (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
The IUPAC name of (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine (CID 138466026) is (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine.
What is the SMILES notation for (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
The canonical SMILES for (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine is NCc1cnn2c1CN(Cc1ccccc1)CC2.
What is the InChIKey of (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
The InChIKey is UAJBTAIXABUPCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c15-8-13-9-16-18-7-6-17(11-14(13)18)10-12-4-2-1-3-5-12/h1-5,9H,6-8,10-11,15H2.
What are the key properties of (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine has a molecular weight of 242.33 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl)methanamine is sourced from PubChem (CID 138466026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).