1-(thian-3-yl)piperidin-4-ol

C10H19NOS — CID 83831949

IUPAC1-(thian-3-yl)piperidin-4-ol
SMILESOC1CCN(C2CCCSC2)CC1
InChIInChI=1S/C10H19NOS/c12-10-3-5-11(6-4-10)9-2-1-7-13-8-9/h9-10,12H,1-8H2
InChIKeyNJBHWLZYJQOPAR-UHFFFAOYSA-N
MW201.33 g/mol
LogP1.34
Rot. Bonds1

About 1-(thian-3-yl)piperidin-4-ol

1-(thian-3-yl)piperidin-4-ol (PubChem CID 83831949) has the molecular formula C10H19NOS and a molecular weight of 201.33 g/mol. Its IUPAC name is 1-(thian-3-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(thian-3-yl)piperidin-4-ol
PubChem CID83831949
Molecular FormulaC10H19NOS
Molecular Weight201.33 g/mol
Exact Mass201.12
IUPAC Name1-(thian-3-yl)piperidin-4-ol
SMILESOC1CCN(C2CCCSC2)CC1
InChIInChI=1S/C10H19NOS/c12-10-3-5-11(6-4-10)9-2-1-7-13-8-9/h9-10,12H,1-8H2
InChIKeyNJBHWLZYJQOPAR-UHFFFAOYSA-N
XLogP1.34
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.33
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(thian-3-yl)piperidin-4-ol 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 1-(thian-3-yl)piperidin-4-ol?
The IUPAC name of 1-(thian-3-yl)piperidin-4-ol (CID 83831949) is 1-(thian-3-yl)piperidin-4-ol.
What is the SMILES notation for 1-(thian-3-yl)piperidin-4-ol?
The canonical SMILES for 1-(thian-3-yl)piperidin-4-ol is OC1CCN(C2CCCSC2)CC1.
What is the InChIKey of 1-(thian-3-yl)piperidin-4-ol?
The InChIKey is NJBHWLZYJQOPAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NOS/c12-10-3-5-11(6-4-10)9-2-1-7-13-8-9/h9-10,12H,1-8H2.
What are the key properties of 1-(thian-3-yl)piperidin-4-ol?
1-(thian-3-yl)piperidin-4-ol has a molecular weight of 201.33 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(thian-3-yl)piperidin-4-ol is sourced from PubChem (CID 83831949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).