N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

C13H17N5O — CID 103120602

IUPACN-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESO=C(NCCCNC1CC1)c1cnn2ccncc12
InChIInChI=1S/C13H17N5O/c19-13(16-5-1-4-15-10-2-3-10)11-8-17-18-7-6-14-9-12(11)18/h6-10,15H,1-5H2,(H,16,19)
InChIKeyFIIIVMLHQLAWDK-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.60
Rot. Bonds6

About N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 103120602) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID103120602
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC NameN-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESO=C(NCCCNC1CC1)c1cnn2ccncc12
InChIInChI=1S/C13H17N5O/c19-13(16-5-1-4-15-10-2-3-10)11-8-17-18-7-6-14-9-12(11)18/h6-10,15H,1-5H2,(H,16,19)
InChIKeyFIIIVMLHQLAWDK-UHFFFAOYSA-N
XLogP0.60
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-chlorobutyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 106845452
N-cyclopentylpyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103119999
methyl 6-(pyrazolo[1,5-a]pyrazine-3-carbonylamino)hexanoate
CID 103121150
N-[[(1R,2R)-2-hydroxycyclohexyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 99779011
N-(3-chlorobutyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103122603
N-pent-3-ynylpyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103122096
N-[(3R)-piperidin-3-yl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103121083
N-(3-azabicyclo[3.1.0]hexan-6-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103120573
N-(3-amino-4-methoxybutyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 106243450
N-(3-bromo-4-methoxybutyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 114163401
N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103121101
N-[(1R,2R)-2-aminocyclohexyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103121138

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (CID 103120602) is N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is O=C(NCCCNC1CC1)c1cnn2ccncc12.
What is the InChIKey of N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is FIIIVMLHQLAWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c19-13(16-5-1-4-15-10-2-3-10)11-8-17-18-7-6-14-9-12(11)18/h6-10,15H,1-5H2,(H,16,19).
What are the key properties of N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 0.60, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylamino)propyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 103120602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).