morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone

C11H12N4O2 — CID 47021395

IUPACmorpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone
SMILESO=C(c1cnn2cccnc12)N1CCOCC1
InChIInChI=1S/C11H12N4O2/c16-11(14-4-6-17-7-5-14)9-8-13-15-3-1-2-12-10(9)15/h1-3,8H,4-7H2
InChIKeyVGRRFKICBQCCRA-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.20
Rot. Bonds1

About morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone

morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone (PubChem CID 47021395) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone
PubChem CID47021395
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Namemorpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone
SMILESO=C(c1cnn2cccnc12)N1CCOCC1
InChIInChI=1S/C11H12N4O2/c16-11(14-4-6-17-7-5-14)9-8-13-15-3-1-2-12-10(9)15/h1-3,8H,4-7H2
InChIKeyVGRRFKICBQCCRA-UHFFFAOYSA-N
XLogP0.20
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone?
The IUPAC name of morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone (CID 47021395) is morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone.
What is the SMILES notation for morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone?
The canonical SMILES for morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone is O=C(c1cnn2cccnc12)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone?
The InChIKey is VGRRFKICBQCCRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c16-11(14-4-6-17-7-5-14)9-8-13-15-3-1-2-12-10(9)15/h1-3,8H,4-7H2.
What are the key properties of morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone?
morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone has a molecular weight of 232.24 g/mol, XLogP of 0.20, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(pyrazolo[1,5-a]pyrimidin-3-yl)methanone is sourced from PubChem (CID 47021395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).