6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine

C14H12N4O2S — CID 164877368

IUPAC6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine
SMILESCc1cnc(-c2noc(-c3cnc4c(c3)CCCO4)n2)s1
InChIInChI=1S/C14H12N4O2S/c1-8-6-16-14(21-8)11-17-13(20-18-11)10-5-9-3-2-4-19-12(9)15-7-10/h5-7H,2-4H2,1H3
InChIKeyBIIONGKUDOTSHC-UHFFFAOYSA-N
MW300.34 g/mol
LogP2.89
Rot. Bonds2

About 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine

6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine (PubChem CID 164877368) has the molecular formula C14H12N4O2S and a molecular weight of 300.34 g/mol. Its IUPAC name is 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine.

Molecular Properties

Compound Name6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine
PubChem CID164877368
Molecular FormulaC14H12N4O2S
Molecular Weight300.34 g/mol
Exact Mass300.07
IUPAC Name6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine
SMILESCc1cnc(-c2noc(-c3cnc4c(c3)CCCO4)n2)s1
InChIInChI=1S/C14H12N4O2S/c1-8-6-16-14(21-8)11-17-13(20-18-11)10-5-9-3-2-4-19-12(9)15-7-10/h5-7H,2-4H2,1H3
InChIKeyBIIONGKUDOTSHC-UHFFFAOYSA-N
XLogP2.89
TPSA73.93 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine?
The IUPAC name of 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine (CID 164877368) is 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine.
What is the SMILES notation for 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine?
The canonical SMILES for 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine is Cc1cnc(-c2noc(-c3cnc4c(c3)CCCO4)n2)s1.
What is the InChIKey of 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine?
The InChIKey is BIIONGKUDOTSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2S/c1-8-6-16-14(21-8)11-17-13(20-18-11)10-5-9-3-2-4-19-12(9)15-7-10/h5-7H,2-4H2,1H3.
What are the key properties of 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine?
6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine has a molecular weight of 300.34 g/mol, XLogP of 2.89, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine is sourced from PubChem (CID 164877368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).