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

C12H16N4O — CID 84795465

IUPAC3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine
SMILESCCc1cc2ncc(C3COCCN3)cn2n1
InChIInChI=1S/C12H16N4O/c1-2-10-5-12-14-6-9(7-16(12)15-10)11-8-17-4-3-13-11/h5-7,11,13H,2-4,8H2,1H3
InChIKeyVADZCJAKSQXXAX-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.95
Rot. Bonds2

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

3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine (PubChem CID 84795465) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine.

Molecular Properties

Compound Name3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine
PubChem CID84795465
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine
SMILESCCc1cc2ncc(C3COCCN3)cn2n1
InChIInChI=1S/C12H16N4O/c1-2-10-5-12-14-6-9(7-16(12)15-10)11-8-17-4-3-13-11/h5-7,11,13H,2-4,8H2,1H3
InChIKeyVADZCJAKSQXXAX-UHFFFAOYSA-N
XLogP0.95
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-Ethyl-5-(piperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 53318090
US9932325, Example 193
CID 132244742
5-methyl-N-(3-morpholin-4-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine;hydrochloride
CID 12366069
5-propyl-N-[2-(tetrahydro-2H-pyran-3-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56915145
2-[(5-Isopropylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propane-1,3-diol
CID 70704892
5-ethyl-2,3-dimethyl-N-(tetrahydro-2H-pyran-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 70732923
1-(5-Isopropylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-amine
CID 70775261
6-ethyl-5-methyl-N~4~-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)pyrimidine-2,4-diamine
CID 72939719
7-(ethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
CID 118746836
N-(oxetan-3-yl)-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 172450129
N-(3-ethoxycyclobutyl)-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 172460495
[3-[(5-Propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]cyclobutyl]methanol
CID 172469863

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
The IUPAC name of 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine (CID 84795465) is 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine.
What is the SMILES notation for 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
The canonical SMILES for 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine is CCc1cc2ncc(C3COCCN3)cn2n1.
What is the InChIKey of 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
The InChIKey is VADZCJAKSQXXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-2-10-5-12-14-6-9(7-16(12)15-10)11-8-17-4-3-13-11/h5-7,11,13H,2-4,8H2,1H3.
What are the key properties of 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine?
3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine has a molecular weight of 232.29 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)morpholine is sourced from PubChem (CID 84795465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).