4-[(2S)-piperidin-2-yl]thiophen-3-ol

C9H13NOS — CID 130699846

IUPAC4-[(2S)-piperidin-2-yl]thiophen-3-ol
SMILESOc1cscc1[C@@H]1CCCCN1
InChIInChI=1S/C9H13NOS/c11-9-6-12-5-7(9)8-3-1-2-4-10-8/h5-6,8,10-11H,1-4H2/t8-/m0/s1
InChIKeyDWLOJZZOZGNFES-QMMMGPOBSA-N
MW183.28 g/mol
LogP2.27
Rot. Bonds1

About 4-[(2S)-piperidin-2-yl]thiophen-3-ol

4-[(2S)-piperidin-2-yl]thiophen-3-ol (PubChem CID 130699846) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 4-[(2S)-piperidin-2-yl]thiophen-3-ol.

Molecular Properties

Compound Name4-[(2S)-piperidin-2-yl]thiophen-3-ol
PubChem CID130699846
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name4-[(2S)-piperidin-2-yl]thiophen-3-ol
SMILESOc1cscc1[C@@H]1CCCCN1
InChIInChI=1S/C9H13NOS/c11-9-6-12-5-7(9)8-3-1-2-4-10-8/h5-6,8,10-11H,1-4H2/t8-/m0/s1
InChIKeyDWLOJZZOZGNFES-QMMMGPOBSA-N
XLogP2.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiophene_hydroxy(28)', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(4-chlorothiophen-3-yl)pyrrolidine
CID 130648179
4-[(2R)-piperidin-2-yl]benzene-1,3-diol;hydrochloride
CID 171195341
3-[(2R)-piperidin-2-yl]benzene-1,2-diol
CID 130665742
3-[(2S)-piperidin-2-yl]benzene-1,2-diol;hydrochloride
CID 171194852
2-chloro-3-piperidin-2-ylphenol
CID 130000735
4-piperidin-2-ylphenol
CID 19711202
2-[(2R)-piperidin-2-yl]benzene-1,3-diol
CID 130679710
4-bromo-2-piperidin-2-ylphenol
CID 82623427
4-[(2R)-piperidin-2-yl]naphthalen-1-ol
CID 171195556
2,4-dihydroxy-5-piperidin-2-ylbenzoic acid
CID 117346375
2-(azepan-2-yl)-5-fluorophenol
CID 107014696
2-fluoro-4-methyl-5-piperidin-2-ylphenol
CID 84780709

Frequently Asked Questions

What is the IUPAC name of 4-[(2S)-piperidin-2-yl]thiophen-3-ol?
The IUPAC name of 4-[(2S)-piperidin-2-yl]thiophen-3-ol (CID 130699846) is 4-[(2S)-piperidin-2-yl]thiophen-3-ol.
What is the SMILES notation for 4-[(2S)-piperidin-2-yl]thiophen-3-ol?
The canonical SMILES for 4-[(2S)-piperidin-2-yl]thiophen-3-ol is Oc1cscc1[C@@H]1CCCCN1.
What is the InChIKey of 4-[(2S)-piperidin-2-yl]thiophen-3-ol?
The InChIKey is DWLOJZZOZGNFES-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H13NOS/c11-9-6-12-5-7(9)8-3-1-2-4-10-8/h5-6,8,10-11H,1-4H2/t8-/m0/s1.
What are the key properties of 4-[(2S)-piperidin-2-yl]thiophen-3-ol?
4-[(2S)-piperidin-2-yl]thiophen-3-ol has a molecular weight of 183.28 g/mol, XLogP of 2.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2S)-piperidin-2-yl]thiophen-3-ol is sourced from PubChem (CID 130699846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).