5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one

C13H18N4O — CID 113446769

IUPAC5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESCC(CNC1CC1)Cn1ccn2nccc2c1=O
InChIInChI=1S/C13H18N4O/c1-10(8-14-11-2-3-11)9-16-6-7-17-12(13(16)18)4-5-15-17/h4-7,10-11,14H,2-3,8-9H2,1H3
InChIKeyIBOQFWKJEHHXKH-UHFFFAOYSA-N
MW246.31 g/mol
LogP0.88
Rot. Bonds5

About 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one

5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 113446769) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one
PubChem CID113446769
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESCC(CNC1CC1)Cn1ccn2nccc2c1=O
InChIInChI=1S/C13H18N4O/c1-10(8-14-11-2-3-11)9-16-6-7-17-12(13(16)18)4-5-15-17/h4-7,10-11,14H,2-3,8-9H2,1H3
InChIKeyIBOQFWKJEHHXKH-UHFFFAOYSA-N
XLogP0.88
TPSA51.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-(cyclopropylamino)-2-hydroxypropyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734863
5-[2-methyl-3-(methylamino)propyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735161
5-[2-cyclopentyl-2-(methylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104748219
5-[2-cyclopropyl-2-(methylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734789
5-[2-hydroxy-3-(methylamino)propyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734857
5-[2-cyclopropyl-2-(propylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734770
5-[3-methyl-2-(propylamino)butyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734766
5-(3-hydroxybutyl)pyrazolo[1,5-a]pyrazin-4-one
CID 104735134
5-[2-amino-2-(oxolan-3-yl)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104748230
5-[(4-oxopyrazolo[1,5-a]pyrazin-5-yl)methyl]oxolane-2-carbohydrazide
CID 104735553
5-(5-aminohexyl)pyrazolo[1,5-a]pyrazin-4-one
CID 113446718
5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one
CID 113446751

Frequently Asked Questions

What is the IUPAC name of 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one (CID 113446769) is 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one is CC(CNC1CC1)Cn1ccn2nccc2c1=O.
What is the InChIKey of 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is IBOQFWKJEHHXKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-10(8-14-11-2-3-11)9-16-6-7-17-12(13(16)18)4-5-15-17/h4-7,10-11,14H,2-3,8-9H2,1H3.
What are the key properties of 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one?
5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 246.31 g/mol, XLogP of 0.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(cyclopropylamino)-2-methylpropyl]pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 113446769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).