4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol

C16H24N4O — CID 91470237

IUPAC4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol
SMILESCCc1cnc2c(cnn2CC)c1NC1CCC(O)CC1
InChIInChI=1S/C16H24N4O/c1-3-11-9-17-16-14(10-18-20(16)4-2)15(11)19-12-5-7-13(21)8-6-12/h9-10,12-13,21H,3-8H2,1-2H3,(H,17,19)
InChIKeyQQQSFRSXVYWAKO-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.73
Rot. Bonds4

About 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol

4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol (PubChem CID 91470237) has the molecular formula C16H24N4O and a molecular weight of 288.40 g/mol. Its IUPAC name is 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol
PubChem CID91470237
Molecular FormulaC16H24N4O
Molecular Weight288.40 g/mol
Exact Mass288.20
IUPAC Name4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol
SMILESCCc1cnc2c(cnn2CC)c1NC1CCC(O)CC1
InChIInChI=1S/C16H24N4O/c1-3-11-9-17-16-14(10-18-20(16)4-2)15(11)19-12-5-7-13(21)8-6-12/h9-10,12-13,21H,3-8H2,1-2H3,(H,17,19)
InChIKeyQQQSFRSXVYWAKO-UHFFFAOYSA-N
XLogP2.73
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol (CID 91470237) is 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol is CCc1cnc2c(cnn2CC)c1NC1CCC(O)CC1.
What is the InChIKey of 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol?
The InChIKey is QQQSFRSXVYWAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-3-11-9-17-16-14(10-18-20(16)4-2)15(11)19-12-5-7-13(21)8-6-12/h9-10,12-13,21H,3-8H2,1-2H3,(H,17,19).
What are the key properties of 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol?
4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol has a molecular weight of 288.40 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1,5-diethylpyrazolo[3,4-b]pyridin-4-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 91470237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).