2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol

C20H24N8O2 — CID 149403071

IUPAC2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol
SMILESC[C@@H]1COCCN1c1cc(-c2ccn(CCO)n2)c2c(n1)c(-c1ccn[nH]1)nn2C
InChIInChI=1S/C20H24N8O2/c1-13-12-30-10-8-28(13)17-11-14(15-4-6-27(24-15)7-9-29)20-19(22-17)18(25-26(20)2)16-3-5-21-23-16/h3-6,11,13,29H,7-10,12H2,1-2H3,(H,21,23)/t13-/m1/s1
InChIKeyYPTRTFPNKOKRNL-CYBMUJFWSA-N
MW408.47 g/mol
LogP1.44
Rot. Bonds5

About 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol

2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol (PubChem CID 149403071) has the molecular formula C20H24N8O2 and a molecular weight of 408.47 g/mol. Its IUPAC name is 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol
PubChem CID149403071
Molecular FormulaC20H24N8O2
Molecular Weight408.47 g/mol
Exact Mass408.20
IUPAC Name2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol
SMILESC[C@@H]1COCCN1c1cc(-c2ccn(CCO)n2)c2c(n1)c(-c1ccn[nH]1)nn2C
InChIInChI=1S/C20H24N8O2/c1-13-12-30-10-8-28(13)17-11-14(15-4-6-27(24-15)7-9-29)20-19(22-17)18(25-26(20)2)16-3-5-21-23-16/h3-6,11,13,29H,7-10,12H2,1-2H3,(H,21,23)/t13-/m1/s1
InChIKeyYPTRTFPNKOKRNL-CYBMUJFWSA-N
XLogP1.44
TPSA109.91 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.47
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol 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-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol (CID 149403071) is 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol is C[C@@H]1COCCN1c1cc(-c2ccn(CCO)n2)c2c(n1)c(-c1ccn[nH]1)nn2C.
What is the InChIKey of 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol?
The InChIKey is YPTRTFPNKOKRNL-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H24N8O2/c1-13-12-30-10-8-28(13)17-11-14(15-4-6-27(24-15)7-9-29)20-19(22-17)18(25-26(20)2)16-3-5-21-23-16/h3-6,11,13,29H,7-10,12H2,1-2H3,(H,21,23)/t13-/m1/s1.
What are the key properties of 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol?
2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol has a molecular weight of 408.47 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[1-methyl-5-[(3R)-3-methylmorpholin-4-yl]-3-(1H-pyrazol-5-yl)pyrazolo[4,5-b]pyridin-7-yl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 149403071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).