N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine

C17H20N4O — CID 133489848

IUPACN,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cccc(OCCN(C)c2nccn3nc(C)cc23)c1
InChIInChI=1S/C17H20N4O/c1-13-5-4-6-15(11-13)22-10-9-20(3)17-16-12-14(2)19-21(16)8-7-18-17/h4-8,11-12H,9-10H2,1-3H3
InChIKeyNEJQWVWEDGGGKW-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.86
Rot. Bonds5

About N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine

N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 133489848) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID133489848
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cccc(OCCN(C)c2nccn3nc(C)cc23)c1
InChIInChI=1S/C17H20N4O/c1-13-5-4-6-15(11-13)22-10-9-20(3)17-16-12-14(2)19-21(16)8-7-18-17/h4-8,11-12H,9-10H2,1-3H3
InChIKeyNEJQWVWEDGGGKW-UHFFFAOYSA-N
XLogP2.86
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
CID 133488518
N-[2-(2-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
CID 133490145
N,4,6-trimethyl-N-[2-(3-methylphenoxy)ethyl]pyrimidin-2-amine
CID 78845383
N-cyclopropyl-N'-methyl-N'-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)ethane-1,2-diamine
CID 113446593
N-methyl-N-[2-(3-methylphenoxy)ethyl]-3-nitropyridin-2-amine
CID 26448919
N,2-dimethyl-N-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104732502
ethyl 3-[methyl-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]propanoate
CID 113446561
4,6-dimethyl-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]pyridine-3-carbonitrile
CID 26448932
N,1-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[5,4-d]pyrimidin-4-amine
CID 26019686
2-methyl-N-(2-phenoxyethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731161
2-methyl-N-(3-phenoxypropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731310
N-(azetidin-3-yl)-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
CID 104732673

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine (CID 133489848) is N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine is Cc1cccc(OCCN(C)c2nccn3nc(C)cc23)c1.
What is the InChIKey of N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is NEJQWVWEDGGGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-13-5-4-6-15(11-13)22-10-9-20(3)17-16-12-14(2)19-21(16)8-7-18-17/h4-8,11-12H,9-10H2,1-3H3.
What are the key properties of N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine?
N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 296.37 g/mol, XLogP of 2.86, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 133489848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).