N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine

C17H20N4 — CID 104730850

IUPACN-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCCc1ccc(C(C)Nc2nccn3nc(C)cc23)cc1
InChIInChI=1S/C17H20N4/c1-4-14-5-7-15(8-6-14)13(3)19-17-16-11-12(2)20-21(16)10-9-18-17/h5-11,13H,4H2,1-3H3,(H,18,19)
InChIKeyOBNFNVBAINLDET-UHFFFAOYSA-N
MW280.38 g/mol
LogP3.77
Rot. Bonds4

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

N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 104730850) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID104730850
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCCc1ccc(C(C)Nc2nccn3nc(C)cc23)cc1
InChIInChI=1S/C17H20N4/c1-4-14-5-7-15(8-6-14)13(3)19-17-16-11-12(2)20-21(16)10-9-18-17/h5-11,13H,4H2,1-3H3,(H,18,19)
InChIKeyOBNFNVBAINLDET-UHFFFAOYSA-N
XLogP3.77
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-chlorophenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730906
N-(1-ethoxypropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 113446324
2-methyl-N-octan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731079
N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 133488724
1-ethyl-3-[1-(4-ethylphenyl)ethylamino]pyrazin-2-one
CID 62939685
N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731642
2-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,2-diamine
CID 104732620
N-(2,3-dimethylbutyl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731637
N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)-N'-propan-2-ylethane-1,2-diamine
CID 113446460
N-[[4-(chloromethyl)phenyl]methyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 107233154
3-chloro-N-[1-(4-ethylphenyl)ethyl]pyridin-2-amine
CID 60701697
N-[1-(4-ethylphenyl)ethyl]-4,6-dimethylpyrimidin-2-amine
CID 60732152

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine (CID 104730850) is N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine is CCc1ccc(C(C)Nc2nccn3nc(C)cc23)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is OBNFNVBAINLDET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-4-14-5-7-15(8-6-14)13(3)19-17-16-11-12(2)20-21(16)10-9-18-17/h5-11,13H,4H2,1-3H3,(H,18,19).
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 280.38 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 104730850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).