(2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide

C16H23N5O2 — CID 94028517

IUPAC(2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide
SMILESCC(C)n1ncc2cc(NC(=O)N3C[C@@H](C)O[C@H](C)C3)cnc21
InChIInChI=1S/C16H23N5O2/c1-10(2)21-15-13(6-18-21)5-14(7-17-15)19-16(22)20-8-11(3)23-12(4)9-20/h5-7,10-12H,8-9H2,1-4H3,(H,19,22)/t11-,12-/m1/s1
InChIKeyJYZCRXUEGDRQPS-VXGBXAGGSA-N
MW317.39 g/mol
LogP2.65
Rot. Bonds2

About (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide

(2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide (PubChem CID 94028517) has the molecular formula C16H23N5O2 and a molecular weight of 317.39 g/mol. Its IUPAC name is (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide
PubChem CID94028517
Molecular FormulaC16H23N5O2
Molecular Weight317.39 g/mol
Exact Mass317.19
IUPAC Name(2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide
SMILESCC(C)n1ncc2cc(NC(=O)N3C[C@@H](C)O[C@H](C)C3)cnc21
InChIInChI=1S/C16H23N5O2/c1-10(2)21-15-13(6-18-21)5-14(7-17-15)19-16(22)20-8-11(3)23-12(4)9-20/h5-7,10-12H,8-9H2,1-4H3,(H,19,22)/t11-,12-/m1/s1
InChIKeyJYZCRXUEGDRQPS-VXGBXAGGSA-N
XLogP2.65
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide 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 (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide?
The IUPAC name of (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide (CID 94028517) is (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide.
What is the SMILES notation for (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide?
The canonical SMILES for (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide is CC(C)n1ncc2cc(NC(=O)N3C[C@@H](C)O[C@H](C)C3)cnc21.
What is the InChIKey of (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide?
The InChIKey is JYZCRXUEGDRQPS-VXGBXAGGSA-N. The full InChI is InChI=1S/C16H23N5O2/c1-10(2)21-15-13(6-18-21)5-14(7-17-15)19-16(22)20-8-11(3)23-12(4)9-20/h5-7,10-12H,8-9H2,1-4H3,(H,19,22)/t11-,12-/m1/s1.
What are the key properties of (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide?
(2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2,6-dimethyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)morpholine-4-carboxamide is sourced from PubChem (CID 94028517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).