[1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol

C15H22N4O — CID 104732060

IUPAC[1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol
SMILESCc1cc2c(NCC3(CO)CCCCC3)nccn2n1
InChIInChI=1S/C15H22N4O/c1-12-9-13-14(16-7-8-19(13)18-12)17-10-15(11-20)5-3-2-4-6-15/h7-9,20H,2-6,10-11H2,1H3,(H,16,17)
InChIKeyGAFFANJDJBOPJW-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.39
Rot. Bonds4

About [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol

[1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol (PubChem CID 104732060) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol
PubChem CID104732060
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name[1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol
SMILESCc1cc2c(NCC3(CO)CCCCC3)nccn2n1
InChIInChI=1S/C15H22N4O/c1-12-9-13-14(16-7-8-19(13)18-12)17-10-15(11-20)5-3-2-4-6-15/h7-9,20H,2-6,10-11H2,1H3,(H,16,17)
InChIKeyGAFFANJDJBOPJW-UHFFFAOYSA-N
XLogP2.39
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol (CID 104732060) is [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol is Cc1cc2c(NCC3(CO)CCCCC3)nccn2n1.
What is the InChIKey of [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol?
The InChIKey is GAFFANJDJBOPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-12-9-13-14(16-7-8-19(13)18-12)17-10-15(11-20)5-3-2-4-6-15/h7-9,20H,2-6,10-11H2,1H3,(H,16,17).
What are the key properties of [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol?
[1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol has a molecular weight of 274.37 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 104732060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).