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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Related Compounds

7-methyl-2-(3-propylpiperidin-3-yl)-1,3-benzoxazole
CID 79601667
6-methoxy-2-(3-propylpiperidin-3-yl)-1,3-benzoxazole
CID 102696219
3-(2-bromophenyl)-5-(3-propylpiperidin-3-yl)-1,2,4-oxadiazole
CID 63137750
3-tert-butyl-5-(3-propylpiperidin-3-yl)-1,2,4-oxadiazole
CID 63137913
7-bromo-2-(3-propylpyrrolidin-3-yl)-1,3-benzoxazole
CID 81494314
2-(4-propylpiperidin-4-yl)-1H-imidazo[4,5-b]pyridine
CID 63125111
3-(2-methylcyclopropyl)-5-(3-propylpiperidin-3-yl)-1,2,4-oxadiazole
CID 65421668
6-chloro-2-(3-ethylpiperidin-3-yl)-1,3-benzoxazole
CID 81433134
3-piperidin-1-yl-5-(3-propylpiperidin-3-yl)-1,2,4-oxadiazole
CID 116807232
3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 63137902
8-(3-propylpiperidin-3-yl)-7H-purine
CID 114402001
8-(3-propylpiperidin-3-yl)-7H-purin-6-amine
CID 114607967

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).