3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one

C16H21N5O2 — CID 56788570

IUPAC3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCN1CCC(c2nnc3ccccn23)CC1
InChIInChI=1S/C16H21N5O2/c22-16-20(11-12-23-16)10-9-19-7-4-13(5-8-19)15-18-17-14-3-1-2-6-21(14)15/h1-3,6,13H,4-5,7-12H2
InChIKeyIXPOVTJVXIMIIH-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.36
Rot. Bonds4

About 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one

3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one (PubChem CID 56788570) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one
PubChem CID56788570
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCN1CCC(c2nnc3ccccn23)CC1
InChIInChI=1S/C16H21N5O2/c22-16-20(11-12-23-16)10-9-19-7-4-13(5-8-19)15-18-17-14-3-1-2-6-21(14)15/h1-3,6,13H,4-5,7-12H2
InChIKeyIXPOVTJVXIMIIH-UHFFFAOYSA-N
XLogP1.36
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one with MolForge

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Related Compounds

5-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]pentanenitrile
CID 86911616
1,3-dimethyl-7-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]purine-2,6-dione
CID 112797028
1-(4-methylphenyl)-3-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]propan-1-one
CID 99712325
3-[1-[2-(4-bromophenyl)sulfonylethyl]piperidin-4-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 78818247
3-(thian-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138801
3-[2-(4-hydroxypiperidin-1-yl)ethyl]-1,3-oxazolidin-2-one
CID 134018850
[4-[[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methyl]phenyl]methanol
CID 110009006
2-methyl-5-[[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methyl]-1,3,4-oxadiazole
CID 86909036
1-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]imidazolidin-2-one
CID 72935222
3-[2-(4-benzoylpiperidin-1-yl)ethyl]-1,3-oxazolidin-2-one
CID 56811485
3-[1-[2-(2,5-dichlorophenyl)sulfonylethyl]piperidin-4-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 78818246
(1R)-1-(3-fluorophenyl)-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethanol
CID 95623551

Frequently Asked Questions

What is the IUPAC name of 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one (CID 56788570) is 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one is O=C1OCCN1CCN1CCC(c2nnc3ccccn23)CC1.
What is the InChIKey of 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one?
The InChIKey is IXPOVTJVXIMIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c22-16-20(11-12-23-16)10-9-19-7-4-13(5-8-19)15-18-17-14-3-1-2-6-21(14)15/h1-3,6,13H,4-5,7-12H2.
What are the key properties of 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one?
3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one has a molecular weight of 315.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 56788570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).