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

C9H11N3O — CID 84767334

IUPAC(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol
SMILESCCc1cc2ncc(CO)cn2n1
InChIInChI=1S/C9H11N3O/c1-2-8-3-9-10-4-7(6-13)5-12(9)11-8/h3-5,13H,2,6H2,1H3
InChIKeyJLVDFJOYUXAXAO-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.78
Rot. Bonds2

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

(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol (PubChem CID 84767334) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol.

Molecular Properties

Compound Name(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol
PubChem CID84767334
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol
SMILESCCc1cc2ncc(CO)cn2n1
InChIInChI=1S/C9H11N3O/c1-2-8-3-9-10-4-7(6-13)5-12(9)11-8/h3-5,13H,2,6H2,1H3
InChIKeyJLVDFJOYUXAXAO-UHFFFAOYSA-N
XLogP0.78
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol?
The IUPAC name of (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol (CID 84767334) is (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol.
What is the SMILES notation for (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol?
The canonical SMILES for (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol is CCc1cc2ncc(CO)cn2n1.
What is the InChIKey of (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol?
The InChIKey is JLVDFJOYUXAXAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-2-8-3-9-10-4-7(6-13)5-12(9)11-8/h3-5,13H,2,6H2,1H3.
What are the key properties of (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol?
(2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol has a molecular weight of 177.21 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpyrazolo[1,5-a]pyrimidin-6-yl)methanol is sourced from PubChem (CID 84767334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).