2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole

C21H21N7O2 — CID 168922110

IUPAC2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole
SMILESc1cc(-c2cc3nc(-n4cc5c(n4)COCC5)cc(N4CCOCC4)n3n2)ccn1
InChIInChI=1S/C21H21N7O2/c1-4-22-5-2-15(1)17-11-20-23-19(27-13-16-3-8-30-14-18(16)24-27)12-21(28(20)25-17)26-6-9-29-10-7-26/h1-2,4-5,11-13H,3,6-10,14H2
InChIKeyGNGLXKSIXQZTCG-UHFFFAOYSA-N
MW403.45 g/mol
LogP1.89
Rot. Bonds3

About 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole

2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole (PubChem CID 168922110) has the molecular formula C21H21N7O2 and a molecular weight of 403.45 g/mol. Its IUPAC name is 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole.

Molecular Properties

Compound Name2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole
PubChem CID168922110
Molecular FormulaC21H21N7O2
Molecular Weight403.45 g/mol
Exact Mass403.18
IUPAC Name2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole
SMILESc1cc(-c2cc3nc(-n4cc5c(n4)COCC5)cc(N4CCOCC4)n3n2)ccn1
InChIInChI=1S/C21H21N7O2/c1-4-22-5-2-15(1)17-11-20-23-19(27-13-16-3-8-30-14-18(16)24-27)12-21(28(20)25-17)26-6-9-29-10-7-26/h1-2,4-5,11-13H,3,6-10,14H2
InChIKeyGNGLXKSIXQZTCG-UHFFFAOYSA-N
XLogP1.89
TPSA82.60 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.45
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole 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 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole?
The IUPAC name of 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole (CID 168922110) is 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole.
What is the SMILES notation for 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole?
The canonical SMILES for 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole is c1cc(-c2cc3nc(-n4cc5c(n4)COCC5)cc(N4CCOCC4)n3n2)ccn1.
What is the InChIKey of 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole?
The InChIKey is GNGLXKSIXQZTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N7O2/c1-4-22-5-2-15(1)17-11-20-23-19(27-13-16-3-8-30-14-18(16)24-27)12-21(28(20)25-17)26-6-9-29-10-7-26/h1-2,4-5,11-13H,3,6-10,14H2.
What are the key properties of 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole?
2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole has a molecular weight of 403.45 g/mol, XLogP of 1.89, 3 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-morpholin-4-yl-2-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazole is sourced from PubChem (CID 168922110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).