(2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol

C13H11N3O2 — CID 107713486

IUPAC(2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol
SMILESOCc1ccccc1Oc1ccn2nccc2n1
InChIInChI=1S/C13H11N3O2/c17-9-10-3-1-2-4-11(10)18-13-6-8-16-12(15-13)5-7-14-16/h1-8,17H,9H2
InChIKeyQPPPABGMZOYDKJ-UHFFFAOYSA-N
MW241.25 g/mol
LogP2.01
Rot. Bonds3

About (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol

(2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol (PubChem CID 107713486) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol.

Molecular Properties

Compound Name(2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol
PubChem CID107713486
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC Name(2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol
SMILESOCc1ccccc1Oc1ccn2nccc2n1
InChIInChI=1S/C13H11N3O2/c17-9-10-3-1-2-4-11(10)18-13-6-8-16-12(15-13)5-7-14-16/h1-8,17H,9H2
InChIKeyQPPPABGMZOYDKJ-UHFFFAOYSA-N
XLogP2.01
TPSA59.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol?
The IUPAC name of (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol (CID 107713486) is (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol.
What is the SMILES notation for (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol?
The canonical SMILES for (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol is OCc1ccccc1Oc1ccn2nccc2n1.
What is the InChIKey of (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol?
The InChIKey is QPPPABGMZOYDKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c17-9-10-3-1-2-4-11(10)18-13-6-8-16-12(15-13)5-7-14-16/h1-8,17H,9H2.
What are the key properties of (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol?
(2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol has a molecular weight of 241.25 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyrazolo[1,5-a]pyrimidin-5-yloxyphenyl)methanol is sourced from PubChem (CID 107713486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).