(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone

C14H18N4O2 — CID 47413889

IUPAC(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
SMILESCc1[nH]nc2ncc(C(=O)N3CC(C)OCC3C)cc12
InChIInChI=1S/C14H18N4O2/c1-8-7-20-9(2)6-18(8)14(19)11-4-12-10(3)16-17-13(12)15-5-11/h4-5,8-9H,6-7H2,1-3H3,(H,15,16,17)
InChIKeyFTVLLKLIYFCDLL-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.52
Rot. Bonds1

About (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone

(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone (PubChem CID 47413889) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone.

Molecular Properties

Compound Name(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
PubChem CID47413889
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
SMILESCc1[nH]nc2ncc(C(=O)N3CC(C)OCC3C)cc12
InChIInChI=1S/C14H18N4O2/c1-8-7-20-9(2)6-18(8)14(19)11-4-12-10(3)16-17-13(12)15-5-11/h4-5,8-9H,6-7H2,1-3H3,(H,15,16,17)
InChIKeyFTVLLKLIYFCDLL-UHFFFAOYSA-N
XLogP1.52
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone 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 (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone?
The IUPAC name of (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone (CID 47413889) is (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone.
What is the SMILES notation for (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone?
The canonical SMILES for (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone is Cc1[nH]nc2ncc(C(=O)N3CC(C)OCC3C)cc12.
What is the InChIKey of (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone?
The InChIKey is FTVLLKLIYFCDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-8-7-20-9(2)6-18(8)14(19)11-4-12-10(3)16-17-13(12)15-5-11/h4-5,8-9H,6-7H2,1-3H3,(H,15,16,17).
What are the key properties of (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone?
(2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone has a molecular weight of 274.32 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylmorpholin-4-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone is sourced from PubChem (CID 47413889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).