2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine

C14H19N3O — CID 113392364

IUPAC2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine
SMILESCCCC1(c2nc3ncccc3o2)CCCNC1
InChIInChI=1S/C14H19N3O/c1-2-6-14(7-4-8-15-10-14)13-17-12-11(18-13)5-3-9-16-12/h3,5,9,15H,2,4,6-8,10H2,1H3
InChIKeyBNHRQWHRFZAHBH-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.64
Rot. Bonds3

About 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine

2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 113392364) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine
PubChem CID113392364
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine
SMILESCCCC1(c2nc3ncccc3o2)CCCNC1
InChIInChI=1S/C14H19N3O/c1-2-6-14(7-4-8-15-10-14)13-17-12-11(18-13)5-3-9-16-12/h3,5,9,15H,2,4,6-8,10H2,1H3
InChIKeyBNHRQWHRFZAHBH-UHFFFAOYSA-N
XLogP2.64
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine (CID 113392364) is 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine is CCCC1(c2nc3ncccc3o2)CCCNC1.
What is the InChIKey of 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is BNHRQWHRFZAHBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-2-6-14(7-4-8-15-10-14)13-17-12-11(18-13)5-3-9-16-12/h3,5,9,15H,2,4,6-8,10H2,1H3.
What are the key properties of 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine?
2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 245.33 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propylpiperidin-3-yl)-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 113392364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).