2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole

C14H16N2OS — CID 113315254

IUPAC2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole
SMILESc1cc2c(o1)CCc1sc(C3CCCCN3)nc1-2
InChIInChI=1S/C14H16N2OS/c1-2-7-15-10(3-1)14-16-13-9-6-8-17-11(9)4-5-12(13)18-14/h6,8,10,15H,1-5,7H2
InChIKeyJLELAPCFQUMKIF-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.32
Rot. Bonds1

About 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole

2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole (PubChem CID 113315254) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole.

Molecular Properties

Compound Name2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole
PubChem CID113315254
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole
SMILESc1cc2c(o1)CCc1sc(C3CCCCN3)nc1-2
InChIInChI=1S/C14H16N2OS/c1-2-7-15-10(3-1)14-16-13-9-6-8-17-11(9)4-5-12(13)18-14/h6,8,10,15H,1-5,7H2
InChIKeyJLELAPCFQUMKIF-UHFFFAOYSA-N
XLogP3.32
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyrrolidin-2-yl-4,5-dihydrobenzo[e][1,3]benzothiazole
CID 62541233
2-piperidin-2-yl-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazole
CID 62541413
5-methyl-4-(4-methylphenyl)-2-piperidin-2-yl-1,3-thiazole
CID 55084812
2-[(2R)-pyrrolidin-2-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 42078499
4,4-dimethyl-2-piperidin-2-ylchromeno[4,3-d][1,3]thiazole
CID 81140549
3-(5-thia-3-azatricyclo[8.4.0.02,6]tetradeca-1(14),2(6),3,10,12-pentaen-4-yl)morpholine
CID 102748312
4-(4-chlorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole
CID 62542301
2-(azepan-2-yl)-[1,3]thiazolo[5,4-b]pyridine
CID 65335157
6-chloro-2-piperidin-2-yl-1,3-benzothiazole
CID 79528887
6-(2-methylbutan-2-yl)-2-piperidin-2-yl-4,5,6,7-tetrahydro-1,3-benzothiazole
CID 62541069
2-(azepan-2-yl)-5-chloro-1,3-benzothiazole
CID 64560708
5-bromo-4-methyl-2-piperidin-2-yl-1,3-thiazole
CID 83693618

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole?
The IUPAC name of 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole (CID 113315254) is 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole.
What is the SMILES notation for 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole?
The canonical SMILES for 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole is c1cc2c(o1)CCc1sc(C3CCCCN3)nc1-2.
What is the InChIKey of 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole?
The InChIKey is JLELAPCFQUMKIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-2-7-15-10(3-1)14-16-13-9-6-8-17-11(9)4-5-12(13)18-14/h6,8,10,15H,1-5,7H2.
What are the key properties of 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole?
2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole has a molecular weight of 260.36 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole is sourced from PubChem (CID 113315254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).