(4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol

C17H15FN4O — CID 129282621

IUPAC(4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
SMILESO[C@H]1c2c(F)cnn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21
InChIInChI=1S/C17H15FN4O/c18-13-7-20-22-6-5-12(17(23)16(13)22)15-11-4-2-1-3-10(11)14-8-19-9-21(14)15/h1-4,7-9,12,15,17,23H,5-6H2/t12-,15+,17-/m1/s1
InChIKeyHIZFDNAQMMDWGP-ISTRZQFTSA-N
MW310.33 g/mol
LogP2.54
Rot. Bonds1

About (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol

(4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol (PubChem CID 129282621) has the molecular formula C17H15FN4O and a molecular weight of 310.33 g/mol. Its IUPAC name is (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol.

Molecular Properties

Compound Name(4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
PubChem CID129282621
Molecular FormulaC17H15FN4O
Molecular Weight310.33 g/mol
Exact Mass310.12
IUPAC Name(4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
SMILESO[C@H]1c2c(F)cnn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21
InChIInChI=1S/C17H15FN4O/c18-13-7-20-22-6-5-12(17(23)16(13)22)15-11-4-2-1-3-10(11)14-8-19-9-21(14)15/h1-4,7-9,12,15,17,23H,5-6H2/t12-,15+,17-/m1/s1
InChIKeyHIZFDNAQMMDWGP-ISTRZQFTSA-N
XLogP2.54
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol 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

US10233190, Example 1474
CID 66558723
US10233190, Example 1501
CID 66558811
US10233190, Example 1502
CID 66558888
2-(5H-imidazo[5,1-a]isoindol-5-yl)-1-phenylethanol
CID 70874868
(4S,5S)-5-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
CID 129282703
(4S,5S)-5-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-1-methyl-4,5,6,7-tetrahydroindazol-4-ol
CID 129283030
(7S,8S)-7-[(5S)-5H-imidazo[5,1-a]isoindol-5-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 129282903
US9018217, {5-Methyl-2-[2-(1-methyl-4-phenyl-1H-imidazol-2-yl)-ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-methanol
CID 66636097
US10899764, Example 18
CID 122650388
US10899764, Example 42
CID 122650397
US10899764, Example 32
CID 122650483
US10899764, Example 41
CID 122650491

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The IUPAC name of (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol (CID 129282621) is (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol.
What is the SMILES notation for (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The canonical SMILES for (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol is O[C@H]1c2c(F)cnn2CC[C@@H]1[C@@H]1c2ccccc2-c2cncn21.
What is the InChIKey of (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The InChIKey is HIZFDNAQMMDWGP-ISTRZQFTSA-N. The full InChI is InChI=1S/C17H15FN4O/c18-13-7-20-22-6-5-12(17(23)16(13)22)15-11-4-2-1-3-10(11)14-8-19-9-21(14)15/h1-4,7-9,12,15,17,23H,5-6H2/t12-,15+,17-/m1/s1.
What are the key properties of (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
(4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol has a molecular weight of 310.33 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-3-fluoro-5-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol is sourced from PubChem (CID 129282621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).