6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C19H26N4O2 — CID 118740571

IUPAC6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCC(C)CNC(=O)c1cc(C2CC2)nc2onc(C3CCNCC3)c12
InChIInChI=1S/C19H26N4O2/c1-11(2)10-21-18(24)14-9-15(12-3-4-12)22-19-16(14)17(23-25-19)13-5-7-20-8-6-13/h9,11-13,20H,3-8,10H2,1-2H3,(H,21,24)
InChIKeyIPNLJPIHABNLIL-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.95
Rot. Bonds5

About 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 118740571) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID118740571
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCC(C)CNC(=O)c1cc(C2CC2)nc2onc(C3CCNCC3)c12
InChIInChI=1S/C19H26N4O2/c1-11(2)10-21-18(24)14-9-15(12-3-4-12)22-19-16(14)17(23-25-19)13-5-7-20-8-6-13/h9,11-13,20H,3-8,10H2,1-2H3,(H,21,24)
InChIKeyIPNLJPIHABNLIL-UHFFFAOYSA-N
XLogP2.95
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 118740571) is 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CC(C)CNC(=O)c1cc(C2CC2)nc2onc(C3CCNCC3)c12.
What is the InChIKey of 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is IPNLJPIHABNLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-11(2)10-21-18(24)14-9-15(12-3-4-12)22-19-16(14)17(23-25-19)13-5-7-20-8-6-13/h9,11-13,20H,3-8,10H2,1-2H3,(H,21,24).
What are the key properties of 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(2-methylpropyl)-3-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 118740571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).