T0Y

1-[(thiophen-3-yl)methyl]piperidin-4-ol

Created: 2020-03-16
Last modified:  2020-03-25

Find related ligands:

Chemical Details

Formal Charge0
Atom Count28
Chiral Atom Count0
Bond Count29
Aromatic Bond Count5
2D diagram of T0Y

Chemical Component Summary

Name1-[(thiophen-3-yl)methyl]piperidin-4-ol
Systematic Name (OpenEye OEToolkits)1-(thiophen-3-ylmethyl)piperidin-4-ol
FormulaC10 H15 N O S
Molecular Weight197.297
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01C1CN(CCC1O)Cc2cscc2
SMILESCACTVS3.385OC1CCN(CC1)Cc2cscc2
SMILESOpenEye OEToolkits2.0.7c1cscc1CN2CCC(CC2)O
Canonical SMILESCACTVS3.385 OC1CCN(CC1)Cc2cscc2
Canonical SMILESOpenEye OEToolkits2.0.7 c1cscc1CN2CCC(CC2)O
InChIInChI1.03 InChI=1S/C10H15NOS/c12-10-1-4-11(5-2-10)7-9-3-6-13-8-9/h3,6,8,10,12H,1-2,4-5,7H2
InChIKeyInChI1.03 JQJVNJKLFUBEBG-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 40476772