N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

C13H20N4O — CID 103127684

IUPACN-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
SMILESCCCOCC(NCC)c1cnn2ccncc12
InChIInChI=1S/C13H20N4O/c1-3-7-18-10-12(15-4-2)11-8-16-17-6-5-14-9-13(11)17/h5-6,8-9,12,15H,3-4,7,10H2,1-2H3
InChIKeyRMXVGWLMUOYBCQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.81
Rot. Bonds7

About N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine (PubChem CID 103127684) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
PubChem CID103127684
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC NameN-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
SMILESCCCOCC(NCC)c1cnn2ccncc12
InChIInChI=1S/C13H20N4O/c1-3-7-18-10-12(15-4-2)11-8-16-17-6-5-14-9-13(11)17/h5-6,8-9,12,15H,3-4,7,10H2,1-2H3
InChIKeyRMXVGWLMUOYBCQ-UHFFFAOYSA-N
XLogP1.81
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylhexan-1-amine
CID 103126621
N-ethyl-3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103125922
N-ethyl-4,4-dimethyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 103126890
N-ethyl-4-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpent-4-en-1-amine
CID 103128181
2-(4-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126121
N,2-diethyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103127786
N-ethyl-2-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 114013583
N-ethyl-2-(oxan-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126820
2-(2-chlorophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126235
N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-3-ylethanamine
CID 103126767
N-ethyl-3-(2-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-amine
CID 103128451
N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 103126562

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
The IUPAC name of N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine (CID 103127684) is N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine.
What is the SMILES notation for N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
The canonical SMILES for N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine is CCCOCC(NCC)c1cnn2ccncc12.
What is the InChIKey of N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
The InChIKey is RMXVGWLMUOYBCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-3-7-18-10-12(15-4-2)11-8-16-17-6-5-14-9-13(11)17/h5-6,8-9,12,15H,3-4,7,10H2,1-2H3.
What are the key properties of N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine has a molecular weight of 248.33 g/mol, XLogP of 1.81, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-propoxy-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine is sourced from PubChem (CID 103127684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).