N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine

C18H22N4O — CID 133488724

IUPACN-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCOc1ccc(C(Nc2nccn3nc(C)cc23)C(C)C)cc1
InChIInChI=1S/C18H22N4O/c1-12(2)17(14-5-7-15(23-4)8-6-14)20-18-16-11-13(3)21-22(16)10-9-19-18/h5-12,17H,1-4H3,(H,19,20)
InChIKeySTKMCBHCNWDNKE-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.86
Rot. Bonds5

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

N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 133488724) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID133488724
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC NameN-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCOc1ccc(C(Nc2nccn3nc(C)cc23)C(C)C)cc1
InChIInChI=1S/C18H22N4O/c1-12(2)17(14-5-7-15(23-4)8-6-14)20-18-16-11-13(3)21-22(16)10-9-19-18/h5-12,17H,1-4H3,(H,19,20)
InChIKeySTKMCBHCNWDNKE-UHFFFAOYSA-N
XLogP3.86
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(4-ethylphenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730850
N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731642
N-(1-ethoxypropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 113446324
N-[1-(3-chlorophenyl)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730906
N-(1-chloro-3-methoxypropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 106181719
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-[2-(4-fluorophenyl)-2-methoxyethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 133492066
2-methyl-N-(2-propan-2-yloxyethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104762381
2-methyl-N-octan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731079
1-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,2-diamine
CID 104732536
N-[2-(4-methoxyphenoxy)ethyl]-N,2-dimethylpyrazolo[1,5-a]pyrazin-4-amine
CID 133488518

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine (CID 133488724) is N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine is COc1ccc(C(Nc2nccn3nc(C)cc23)C(C)C)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is STKMCBHCNWDNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O/c1-12(2)17(14-5-7-15(23-4)8-6-14)20-18-16-11-13(3)21-22(16)10-9-19-18/h5-12,17H,1-4H3,(H,19,20).
What are the key properties of N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 310.40 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 133488724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).