N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine

C16H19N5 — CID 107368386

IUPACN'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
SMILESNCCCN(Cc1ccccc1)c1nccn2nccc12
InChIInChI=1S/C16H19N5/c17-8-4-11-20(13-14-5-2-1-3-6-14)16-15-7-9-19-21(15)12-10-18-16/h1-3,5-7,9-10,12H,4,8,11,13,17H2
InChIKeyLWEDUZHLUDQXEA-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.08
Rot. Bonds6

About N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine

N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine (PubChem CID 107368386) has the molecular formula C16H19N5 and a molecular weight of 281.36 g/mol. Its IUPAC name is N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
PubChem CID107368386
Molecular FormulaC16H19N5
Molecular Weight281.36 g/mol
Exact Mass281.16
IUPAC NameN'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
SMILESNCCCN(Cc1ccccc1)c1nccn2nccc12
InChIInChI=1S/C16H19N5/c17-8-4-11-20(13-14-5-2-1-3-6-14)16-15-7-9-19-21(15)12-10-18-16/h1-3,5-7,9-10,12H,4,8,11,13,17H2
InChIKeyLWEDUZHLUDQXEA-UHFFFAOYSA-N
XLogP2.08
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N'-ethyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
CID 104729830
N'-benzyl-N'-(3-fluoro-2-pyridinyl)propane-1,3-diamine
CID 107368121
N'-cycloheptyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
CID 104729848
N-[(4-aminophenyl)methyl]-N-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104732904
N'-cyclopropyl-N'-pyrazolo[1,5-a]pyrazin-4-ylethane-1,2-diamine
CID 104734227
N'-benzyl-N'-(5-chloro-3-fluoro-2-pyridinyl)propane-1,3-diamine
CID 107368165
N'-benzyl-N'-(3-methyl-2-pyridinyl)ethane-1,2-diamine
CID 62255300
N'-benzyl-N'-(5-fluoropyrimidin-2-yl)propane-1,3-diamine
CID 107368571
N'-benzyl-N'-(3-bromo-2-pyridinyl)ethane-1,2-diamine
CID 61375800
N'-benzyl-N'-(2-methyl-4-pyridinyl)propane-1,3-diamine
CID 107368407
N-methyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 171691640
N'-benzyl-N'-furo[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 106535010

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine?
The IUPAC name of N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine (CID 107368386) is N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine.
What is the SMILES notation for N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine?
The canonical SMILES for N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine is NCCCN(Cc1ccccc1)c1nccn2nccc12.
What is the InChIKey of N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine?
The InChIKey is LWEDUZHLUDQXEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5/c17-8-4-11-20(13-14-5-2-1-3-6-14)16-15-7-9-19-21(15)12-10-18-16/h1-3,5-7,9-10,12H,4,8,11,13,17H2.
What are the key properties of N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine?
N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine has a molecular weight of 281.36 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine is sourced from PubChem (CID 107368386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).