N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine

C12H18N4O — CID 104731642

IUPACN-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCOCCC(C)Nc1nccn2nc(C)cc12
InChIInChI=1S/C12H18N4O/c1-9(4-7-17-3)14-12-11-8-10(2)15-16(11)6-5-13-12/h5-6,8-9H,4,7H2,1-3H3,(H,13,14)
InChIKeyWOWLKEPOSJPIPY-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.87
Rot. Bonds5

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

N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 104731642) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID104731642
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC NameN-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCOCCC(C)Nc1nccn2nc(C)cc12
InChIInChI=1S/C12H18N4O/c1-9(4-7-17-3)14-12-11-8-10(2)15-16(11)6-5-13-12/h5-6,8-9H,4,7H2,1-3H3,(H,13,14)
InChIKeyWOWLKEPOSJPIPY-UHFFFAOYSA-N
XLogP1.87
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxybutan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731643
2-methyl-N-octan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731079
N-(1-ethoxypropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 113446324
N-(1-chloro-3-methoxypropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 106181719
2-methyl-N-(2-propan-2-yloxyethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104762381
2-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,2-diamine
CID 104732620
N'-(2-methoxyethyl)-N'-methyl-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)ethane-1,2-diamine
CID 104731385
4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol
CID 106253692
N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 133488724
N-(2,3-dimethylbutyl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731637
1-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)propane-1,2-diamine
CID 104732536
N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)-N'-propan-2-ylethane-1,2-diamine
CID 113446460

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine (CID 104731642) is N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine is COCCC(C)Nc1nccn2nc(C)cc12.
What is the InChIKey of N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is WOWLKEPOSJPIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-9(4-7-17-3)14-12-11-8-10(2)15-16(11)6-5-13-12/h5-6,8-9H,4,7H2,1-3H3,(H,13,14).
What are the key properties of N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 234.30 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxybutan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 104731642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).