(3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol

C11H17NOS — CID 131084735

IUPAC(3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol
SMILESC[C@@H]1C[C@H](O)CN(Cc2ccsc2)C1
InChIInChI=1S/C11H17NOS/c1-9-4-11(13)7-12(5-9)6-10-2-3-14-8-10/h2-3,8-9,11,13H,4-7H2,1H3/t9-,11+/m1/s1
InChIKeyGXMHLFRPGUKOQV-KOLCDFICSA-N
MW211.33 g/mol
LogP1.95
Rot. Bonds2

About (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol

(3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol (PubChem CID 131084735) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name(3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol
PubChem CID131084735
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name(3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol
SMILESC[C@@H]1C[C@H](O)CN(Cc2ccsc2)C1
InChIInChI=1S/C11H17NOS/c1-9-4-11(13)7-12(5-9)6-10-2-3-14-8-10/h2-3,8-9,11,13H,4-7H2,1H3/t9-,11+/m1/s1
InChIKeyGXMHLFRPGUKOQV-KOLCDFICSA-N
XLogP1.95
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol with MolForge

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

Launch Full Analysis

Related Compounds

1-(thiophen-3-ylmethyl)pyrrolidin-3-ol
CID 62916311
5-methyl-1-(1,3-thiazol-2-ylmethyl)piperidin-3-ol
CID 130802820
(3S,5R)-5-methyl-1-(1,3-thiazol-2-ylmethyl)piperidin-3-ol
CID 130802814
2-[1-(thiophen-3-ylmethyl)azetidin-3-yl]propanoic acid
CID 116684210
1-[1-(thiophen-3-ylmethyl)azetidin-3-yl]triazole
CID 121183795
4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
CID 79015530
1-(thiophen-3-ylmethyl)azetidine
CID 131087701
4-methyl-1-(thiophen-3-ylmethyl)piperidine-2-carboxylic acid
CID 114426332
(3S,5S)-1-ethyl-5-methylpiperidin-3-ol
CID 1415650
3-methyl-1-(2-thiophen-3-ylethyl)pyrrolidine
CID 127001246
[(3R)-1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
CID 129367813
4-bromo-3,3-dimethyl-1-(thiophen-3-ylmethyl)pyrrolidine
CID 130892965

Frequently Asked Questions

What is the IUPAC name of (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol?
The IUPAC name of (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol (CID 131084735) is (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol.
What is the SMILES notation for (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol?
The canonical SMILES for (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol is C[C@@H]1C[C@H](O)CN(Cc2ccsc2)C1.
What is the InChIKey of (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol?
The InChIKey is GXMHLFRPGUKOQV-KOLCDFICSA-N. The full InChI is InChI=1S/C11H17NOS/c1-9-4-11(13)7-12(5-9)6-10-2-3-14-8-10/h2-3,8-9,11,13H,4-7H2,1H3/t9-,11+/m1/s1.
What are the key properties of (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol?
(3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol has a molecular weight of 211.33 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,5R)-5-methyl-1-(thiophen-3-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 131084735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).