N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine

C15H15FN6O — CID 30859359

IUPACN-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESFc1ccc(Nc2nc(N3CCOCC3)nc3[nH]ncc23)cc1
InChIInChI=1S/C15H15FN6O/c16-10-1-3-11(4-2-10)18-13-12-9-17-21-14(12)20-15(19-13)22-5-7-23-8-6-22/h1-4,9H,5-8H2,(H2,17,18,19,20,21)
InChIKeyALXXXCXQNDTUNV-UHFFFAOYSA-N
MW314.32 g/mol
LogP2.07
Rot. Bonds3

About N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine

N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 30859359) has the molecular formula C15H15FN6O and a molecular weight of 314.32 g/mol. Its IUPAC name is N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID30859359
Molecular FormulaC15H15FN6O
Molecular Weight314.32 g/mol
Exact Mass314.13
IUPAC NameN-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESFc1ccc(Nc2nc(N3CCOCC3)nc3[nH]ncc23)cc1
InChIInChI=1S/C15H15FN6O/c16-10-1-3-11(4-2-10)18-13-12-9-17-21-14(12)20-15(19-13)22-5-7-23-8-6-22/h1-4,9H,5-8H2,(H2,17,18,19,20,21)
InChIKeyALXXXCXQNDTUNV-UHFFFAOYSA-N
XLogP2.07
TPSA78.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine (CID 30859359) is N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine is Fc1ccc(Nc2nc(N3CCOCC3)nc3[nH]ncc23)cc1.
What is the InChIKey of N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is ALXXXCXQNDTUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN6O/c16-10-1-3-11(4-2-10)18-13-12-9-17-21-14(12)20-15(19-13)22-5-7-23-8-6-22/h1-4,9H,5-8H2,(H2,17,18,19,20,21).
What are the key properties of N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 314.32 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-6-morpholin-4-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 30859359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).