T0Y
1-[(thiophen-3-yl)methyl]piperidin-4-ol
Created: | 2020-03-16 |
Last modified: | 2020-03-25 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 28 |
Chiral Atom Count | 0 |
Bond Count | 29 |
Aromatic Bond Count | 5 |
Chemical Component Summary | |
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Name | 1-[(thiophen-3-yl)methyl]piperidin-4-ol |
Systematic Name (OpenEye OEToolkits) | 1-(thiophen-3-ylmethyl)piperidin-4-ol |
Formula | C10 H15 N O S |
Molecular Weight | 197.297 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C1CN(CCC1O)Cc2cscc2 |
SMILES | CACTVS | 3.385 | OC1CCN(CC1)Cc2cscc2 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cscc1CN2CCC(CC2)O |
Canonical SMILES | CACTVS | 3.385 | OC1CCN(CC1)Cc2cscc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1cscc1CN2CCC(CC2)O |
InChI | InChI | 1.03 | 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 |
InChIKey | InChI | 1.03 | JQJVNJKLFUBEBG-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 40476772 |