6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide

C17H17N5O3 — CID 146041738

IUPAC6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1nc2ncccc2o1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C17H17N5O3/c23-17(20-11-15-21-16-13(25-15)2-1-5-18-16)12-3-4-14(19-10-12)22-6-8-24-9-7-22/h1-5,10H,6-9,11H2,(H,20,23)
InChIKeyTZVIYSHYNIXKBH-UHFFFAOYSA-N
MW339.36 g/mol
LogP1.38
Rot. Bonds4

About 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide

6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 146041738) has the molecular formula C17H17N5O3 and a molecular weight of 339.36 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide
PubChem CID146041738
Molecular FormulaC17H17N5O3
Molecular Weight339.36 g/mol
Exact Mass339.13
IUPAC Name6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1nc2ncccc2o1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C17H17N5O3/c23-17(20-11-15-21-16-13(25-15)2-1-5-18-16)12-3-4-14(19-10-12)22-6-8-24-9-7-22/h1-5,10H,6-9,11H2,(H,20,23)
InChIKeyTZVIYSHYNIXKBH-UHFFFAOYSA-N
XLogP1.38
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.36
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide (CID 146041738) is 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide is O=C(NCc1nc2ncccc2o1)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is TZVIYSHYNIXKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O3/c23-17(20-11-15-21-16-13(25-15)2-1-5-18-16)12-3-4-14(19-10-12)22-6-8-24-9-7-22/h1-5,10H,6-9,11H2,(H,20,23).
What are the key properties of 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide?
6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 339.36 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-([1,3]oxazolo[4,5-b]pyridin-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 146041738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).