4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol

C13H20N4O2 — CID 106253692

IUPAC4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol
SMILESCOCCC(C)(O)CNc1nccn2nc(C)cc12
InChIInChI=1S/C13H20N4O2/c1-10-8-11-12(14-5-6-17(11)16-10)15-9-13(2,18)4-7-19-3/h5-6,8,18H,4,7,9H2,1-3H3,(H,14,15)
InChIKeyIFUVIEXJAXCKEQ-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.24
Rot. Bonds6

About 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol

4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol (PubChem CID 106253692) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol.

Molecular Properties

Compound Name4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol
PubChem CID106253692
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol
SMILESCOCCC(C)(O)CNc1nccn2nc(C)cc12
InChIInChI=1S/C13H20N4O2/c1-10-8-11-12(14-5-6-17(11)16-10)15-9-13(2,18)4-7-19-3/h5-6,8,18H,4,7,9H2,1-3H3,(H,14,15)
InChIKeyIFUVIEXJAXCKEQ-UHFFFAOYSA-N
XLogP1.24
TPSA71.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol?
The IUPAC name of 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol (CID 106253692) is 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol.
What is the SMILES notation for 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol?
The canonical SMILES for 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol is COCCC(C)(O)CNc1nccn2nc(C)cc12.
What is the InChIKey of 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol?
The InChIKey is IFUVIEXJAXCKEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-10-8-11-12(14-5-6-17(11)16-10)15-9-13(2,18)4-7-19-3/h5-6,8,18H,4,7,9H2,1-3H3,(H,14,15).
What are the key properties of 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol?
4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol has a molecular weight of 264.33 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-1-[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-2-ol is sourced from PubChem (CID 106253692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).