N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine

C17H20N4O2 — CID 133490145

IUPACN-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCOc1ccccc1OCCN(C)c1nccn2nc(C)cc12
InChIInChI=1S/C17H20N4O2/c1-13-12-14-17(18-8-9-21(14)19-13)20(2)10-11-23-16-7-5-4-6-15(16)22-3/h4-9,12H,10-11H2,1-3H3
InChIKeyFMXKHSVOZQIFOB-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.56
Rot. Bonds6

About N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine

N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 133490145) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID133490145
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC NameN-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCOc1ccccc1OCCN(C)c1nccn2nc(C)cc12
InChIInChI=1S/C17H20N4O2/c1-13-12-14-17(18-8-9-21(14)19-13)20(2)10-11-23-16-7-5-4-6-15(16)22-3/h4-9,12H,10-11H2,1-3H3
InChIKeyFMXKHSVOZQIFOB-UHFFFAOYSA-N
XLogP2.56
TPSA51.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine (CID 133490145) is N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine is COc1ccccc1OCCN(C)c1nccn2nc(C)cc12.
What is the InChIKey of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is FMXKHSVOZQIFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-13-12-14-17(18-8-9-21(14)19-13)20(2)10-11-23-16-7-5-4-6-15(16)22-3/h4-9,12H,10-11H2,1-3H3.
What are the key properties of N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine?
N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 312.37 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 133490145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).