3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine

C11H14N4O — CID 84786121

IUPAC3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine
SMILESCc1cc2ncc(C3COCCN3)cn2n1
InChIInChI=1S/C11H14N4O/c1-8-4-11-13-5-9(6-15(11)14-8)10-7-16-3-2-12-10/h4-6,10,12H,2-3,7H2,1H3
InChIKeyRJPLRKUBHJSCNZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.70
Rot. Bonds1

About 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine

3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine (PubChem CID 84786121) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine.

Molecular Properties

Compound Name3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine
PubChem CID84786121
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine
SMILESCc1cc2ncc(C3COCCN3)cn2n1
InChIInChI=1S/C11H14N4O/c1-8-4-11-13-5-9(6-15(11)14-8)10-7-16-3-2-12-10/h4-6,10,12H,2-3,7H2,1H3
InChIKeyRJPLRKUBHJSCNZ-UHFFFAOYSA-N
XLogP0.70
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
The IUPAC name of 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine (CID 84786121) is 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine.
What is the SMILES notation for 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
The canonical SMILES for 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine is Cc1cc2ncc(C3COCCN3)cn2n1.
What is the InChIKey of 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
The InChIKey is RJPLRKUBHJSCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8-4-11-13-5-9(6-15(11)14-8)10-7-16-3-2-12-10/h4-6,10,12H,2-3,7H2,1H3.
What are the key properties of 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine has a molecular weight of 218.26 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine is sourced from PubChem (CID 84786121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).