4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol

C14H19N5O — CID 156846825

IUPAC4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol
SMILESNc1nn(C2CCC(O)CC2)c2nc(C3CC3)cnc12
InChIInChI=1S/C14H19N5O/c15-13-12-14(17-11(7-16-12)8-1-2-8)19(18-13)9-3-5-10(20)6-4-9/h7-10,20H,1-6H2,(H2,15,18)
InChIKeyFOSDCBMDIKICBC-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.76
Rot. Bonds2

About 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol

4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol (PubChem CID 156846825) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol
PubChem CID156846825
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol
SMILESNc1nn(C2CCC(O)CC2)c2nc(C3CC3)cnc12
InChIInChI=1S/C14H19N5O/c15-13-12-14(17-11(7-16-12)8-1-2-8)19(18-13)9-3-5-10(20)6-4-9/h7-10,20H,1-6H2,(H2,15,18)
InChIKeyFOSDCBMDIKICBC-UHFFFAOYSA-N
XLogP1.76
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol?
The IUPAC name of 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol (CID 156846825) is 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol is Nc1nn(C2CCC(O)CC2)c2nc(C3CC3)cnc12.
What is the InChIKey of 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol?
The InChIKey is FOSDCBMDIKICBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c15-13-12-14(17-11(7-16-12)8-1-2-8)19(18-13)9-3-5-10(20)6-4-9/h7-10,20H,1-6H2,(H2,15,18).
What are the key properties of 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol?
4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol has a molecular weight of 273.34 g/mol, XLogP of 1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-6-cyclopropylpyrazolo[3,4-b]pyrazin-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 156846825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).