1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide

C16H16N6O2 — CID 134795335

IUPAC1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cncnc1)C1CCN(c2nc3ncccc3o2)CC1
InChIInChI=1S/C16H16N6O2/c23-15(20-12-8-17-10-18-9-12)11-3-6-22(7-4-11)16-21-14-13(24-16)2-1-5-19-14/h1-2,5,8-11H,3-4,6-7H2,(H,20,23)
InChIKeyUONGTIIOAPIXDJ-UHFFFAOYSA-N
MW324.34 g/mol
LogP1.87
Rot. Bonds3

About 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide

1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide (PubChem CID 134795335) has the molecular formula C16H16N6O2 and a molecular weight of 324.34 g/mol. Its IUPAC name is 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide
PubChem CID134795335
Molecular FormulaC16H16N6O2
Molecular Weight324.34 g/mol
Exact Mass324.13
IUPAC Name1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cncnc1)C1CCN(c2nc3ncccc3o2)CC1
InChIInChI=1S/C16H16N6O2/c23-15(20-12-8-17-10-18-9-12)11-3-6-22(7-4-11)16-21-14-13(24-16)2-1-5-19-14/h1-2,5,8-11H,3-4,6-7H2,(H,20,23)
InChIKeyUONGTIIOAPIXDJ-UHFFFAOYSA-N
XLogP1.87
TPSA97.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide?
The IUPAC name of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide (CID 134795335) is 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide is O=C(Nc1cncnc1)C1CCN(c2nc3ncccc3o2)CC1.
What is the InChIKey of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide?
The InChIKey is UONGTIIOAPIXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N6O2/c23-15(20-12-8-17-10-18-9-12)11-3-6-22(7-4-11)16-21-14-13(24-16)2-1-5-19-14/h1-2,5,8-11H,3-4,6-7H2,(H,20,23).
What are the key properties of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide?
1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-pyrimidin-5-ylpiperidine-4-carboxamide is sourced from PubChem (CID 134795335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).