(6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine

C14H16N8O — CID 170724777

IUPAC(6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine
SMILESNNc1nc(N2CCOCC2)nc2c1cnn2-c1ccncc1
InChIInChI=1S/C14H16N8O/c15-20-12-11-9-17-22(10-1-3-16-4-2-10)13(11)19-14(18-12)21-5-7-23-8-6-21/h1-4,9H,5-8,15H2,(H,18,19,20)
InChIKeyQUXZCBIWNFGKPH-UHFFFAOYSA-N
MW312.34 g/mol
LogP0.33
Rot. Bonds3

About (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine

(6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine (PubChem CID 170724777) has the molecular formula C14H16N8O and a molecular weight of 312.34 g/mol. Its IUPAC name is (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine
PubChem CID170724777
Molecular FormulaC14H16N8O
Molecular Weight312.34 g/mol
Exact Mass312.14
IUPAC Name(6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine
SMILESNNc1nc(N2CCOCC2)nc2c1cnn2-c1ccncc1
InChIInChI=1S/C14H16N8O/c15-20-12-11-9-17-22(10-1-3-16-4-2-10)13(11)19-14(18-12)21-5-7-23-8-6-21/h1-4,9H,5-8,15H2,(H,18,19,20)
InChIKeyQUXZCBIWNFGKPH-UHFFFAOYSA-N
XLogP0.33
TPSA107.01 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine?
The IUPAC name of (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine (CID 170724777) is (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine is NNc1nc(N2CCOCC2)nc2c1cnn2-c1ccncc1.
What is the InChIKey of (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine?
The InChIKey is QUXZCBIWNFGKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N8O/c15-20-12-11-9-17-22(10-1-3-16-4-2-10)13(11)19-14(18-12)21-5-7-23-8-6-21/h1-4,9H,5-8,15H2,(H,18,19,20).
What are the key properties of (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine?
(6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine has a molecular weight of 312.34 g/mol, XLogP of 0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for (6-morpholin-4-yl-1-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine is sourced from PubChem (CID 170724777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).