(3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol

C14H12FN3O — CID 107130605

IUPAC(3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol
SMILESCc1ccc(C(O)c2cnn3ccncc23)cc1F
InChIInChI=1S/C14H12FN3O/c1-9-2-3-10(6-12(9)15)14(19)11-7-17-18-5-4-16-8-13(11)18/h2-8,14,19H,1H3
InChIKeyQEUFTEPESBKQEG-UHFFFAOYSA-N
MW257.27 g/mol
LogP2.26
Rot. Bonds2

About (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol

(3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol (PubChem CID 107130605) has the molecular formula C14H12FN3O and a molecular weight of 257.27 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol
PubChem CID107130605
Molecular FormulaC14H12FN3O
Molecular Weight257.27 g/mol
Exact Mass257.10
IUPAC Name(3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol
SMILESCc1ccc(C(O)c2cnn3ccncc23)cc1F
InChIInChI=1S/C14H12FN3O/c1-9-2-3-10(6-12(9)15)14(19)11-7-17-18-5-4-16-8-13(11)18/h2-8,14,19H,1H3
InChIKeyQEUFTEPESBKQEG-UHFFFAOYSA-N
XLogP2.26
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.27
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol?
The IUPAC name of (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol (CID 107130605) is (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol?
The canonical SMILES for (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol is Cc1ccc(C(O)c2cnn3ccncc23)cc1F.
What is the InChIKey of (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol?
The InChIKey is QEUFTEPESBKQEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3O/c1-9-2-3-10(6-12(9)15)14(19)11-7-17-18-5-4-16-8-13(11)18/h2-8,14,19H,1H3.
What are the key properties of (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol?
(3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol has a molecular weight of 257.27 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanol is sourced from PubChem (CID 107130605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).