2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol

C14H11F2N3O — CID 118664609

IUPAC2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol
SMILESOCC(F)(F)c1ccc(-c2cnc3ccnn3c2)cc1
InChIInChI=1S/C14H11F2N3O/c15-14(16,9-20)12-3-1-10(2-4-12)11-7-17-13-5-6-18-19(13)8-11/h1-8,20H,9H2
InChIKeyVWIZKDHGZGOGIE-UHFFFAOYSA-N
MW275.26 g/mol
LogP2.48
Rot. Bonds3

About 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol

2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol (PubChem CID 118664609) has the molecular formula C14H11F2N3O and a molecular weight of 275.26 g/mol. Its IUPAC name is 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol.

Molecular Properties

Compound Name2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol
PubChem CID118664609
Molecular FormulaC14H11F2N3O
Molecular Weight275.26 g/mol
Exact Mass275.09
IUPAC Name2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol
SMILESOCC(F)(F)c1ccc(-c2cnc3ccnn3c2)cc1
InChIInChI=1S/C14H11F2N3O/c15-14(16,9-20)12-3-1-10(2-4-12)11-7-17-13-5-6-18-19(13)8-11/h1-8,20H,9H2
InChIKeyVWIZKDHGZGOGIE-UHFFFAOYSA-N
XLogP2.48
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.26
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Methyl-6-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
CID 1474430
8-(4-Trifluoromethyl-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-ylamine
CID 57514090
(2R)-7-amino-2-[[7-[(2-fluorophenyl)methylamino]-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl]amino]heptan-1-ol
CID 59534278
trans-4-((3-(3-(Trifluoromethyl)phenyl)pyrazolo[1,5-a]pyrimidin-5-yl)amino)cyclohexanol
CID 66598095
1-Methyl-4-[[3-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
CID 66598186
(2S)-2-[[3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]-3-methylbutan-1-ol
CID 45489074
6-(4-Propan-2-ylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 57326911
N-(oxan-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 118720918
N-(oxan-4-yl)-3-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 66597994
[4-[[3-[3-(Trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexyl]methanol
CID 66598179
US10800776, Example 21
CID 132159527
[2-([1,2,4]Triazolo[4,3-a]pyridin-6-yl)phenyl]methanol
CID 49786340

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol?
The IUPAC name of 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol (CID 118664609) is 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol.
What is the SMILES notation for 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol?
The canonical SMILES for 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol is OCC(F)(F)c1ccc(-c2cnc3ccnn3c2)cc1.
What is the InChIKey of 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol?
The InChIKey is VWIZKDHGZGOGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3O/c15-14(16,9-20)12-3-1-10(2-4-12)11-7-17-13-5-6-18-19(13)8-11/h1-8,20H,9H2.
What are the key properties of 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol?
2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol has a molecular weight of 275.26 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-2-(4-pyrazolo[1,5-a]pyrimidin-6-ylphenyl)ethanol is sourced from PubChem (CID 118664609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).