5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C24H27FN6O3 — CID 129093925

IUPAC5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(N[C@@H]1C2CC[C@@](O)(C2)[C@@H]1CO)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12
InChIInChI=1S/C24H27FN6O3/c25-16-8-15(10-26-11-16)19-2-1-6-30(19)20-4-7-31-22(28-20)17(12-27-31)23(33)29-21-14-3-5-24(34,9-14)18(21)13-32/h4,7-8,10-12,14,18-19,21,32,34H,1-3,5-6,9,13H2,(H,29,33)/t14?,18-,19-,21-,24-/m1/s1
InChIKeyMYAVMGXTFWCGCV-VTODMMRYSA-N
MW466.52 g/mol
LogP1.86
Rot. Bonds5

About 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 129093925) has the molecular formula C24H27FN6O3 and a molecular weight of 466.52 g/mol. Its IUPAC name is 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID129093925
Molecular FormulaC24H27FN6O3
Molecular Weight466.52 g/mol
Exact Mass466.21
IUPAC Name5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(N[C@@H]1C2CC[C@@](O)(C2)[C@@H]1CO)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12
InChIInChI=1S/C24H27FN6O3/c25-16-8-15(10-26-11-16)19-2-1-6-30(19)20-4-7-31-22(28-20)17(12-27-31)23(33)29-21-14-3-5-24(34,9-14)18(21)13-32/h4,7-8,10-12,14,18-19,21,32,34H,1-3,5-6,9,13H2,(H,29,33)/t14?,18-,19-,21-,24-/m1/s1
InChIKeyMYAVMGXTFWCGCV-VTODMMRYSA-N
XLogP1.86
TPSA115.88 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.52
LogP ≤ 51.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide 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

5-[2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-(2-hydroxycyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 77304224
5-[2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-(1-methylcyclobutyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67501208
N'-acetyl-5-[2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbohydrazide
CID 121395159
5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67500608
N-cyclopropyl-5-[(2R)-2-[5-fluoro-2-(hydroxymethyl)-3-pyridinyl]pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 68914782
(2E)-2-[[5-[2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]butanoic acid
CID 121394932
5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-(1-methylcyclopropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67500247
5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-(1-methylcyclopropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67500249
5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]-N-[(2R)-2,3-dihydroxypropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67500507
5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-propan-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67502090
N-[(2R)-2,3-dihydroxypropyl]-5-[(2R)-2-[5-fluoro-2-(hydroxymethyl)phenyl]pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 68913074
5-[2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-(2-hydroxypropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67501570

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 129093925) is 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(N[C@@H]1C2CC[C@@](O)(C2)[C@@H]1CO)c1cnn2ccc(N3CCC[C@@H]3c3cncc(F)c3)nc12.
What is the InChIKey of 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is MYAVMGXTFWCGCV-VTODMMRYSA-N. The full InChI is InChI=1S/C24H27FN6O3/c25-16-8-15(10-26-11-16)19-2-1-6-30(19)20-4-7-31-22(28-20)17(12-27-31)23(33)29-21-14-3-5-24(34,9-14)18(21)13-32/h4,7-8,10-12,14,18-19,21,32,34H,1-3,5-6,9,13H2,(H,29,33)/t14?,18-,19-,21-,24-/m1/s1.
What are the key properties of 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 466.52 g/mol, XLogP of 1.86, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-2-(5-fluoro-3-pyridinyl)pyrrolidin-1-yl]-N-[(2R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 129093925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).