(2S)-2-thiophen-2-ylpiperidine

C9H13NS — CID 7022116

IUPAC(2S)-2-thiophen-2-ylpiperidine
SMILESc1csc([C@@H]2CCCCN2)c1
InChIInChI=1S/C9H13NS/c1-2-6-10-8(4-1)9-5-3-7-11-9/h3,5,7-8,10H,1-2,4,6H2/t8-/m0/s1
InChIKeyIRHBPLJGCWXMPV-QMMMGPOBSA-N
MW167.28 g/mol
LogP2.56
Rot. Bonds1

About (2S)-2-thiophen-2-ylpiperidine

(2S)-2-thiophen-2-ylpiperidine (PubChem CID 7022116) has the molecular formula C9H13NS and a molecular weight of 167.28 g/mol. Its IUPAC name is (2S)-2-thiophen-2-ylpiperidine.

Molecular Properties

Compound Name(2S)-2-thiophen-2-ylpiperidine
PubChem CID7022116
Molecular FormulaC9H13NS
Molecular Weight167.28 g/mol
Exact Mass167.08
IUPAC Name(2S)-2-thiophen-2-ylpiperidine
SMILESc1csc([C@@H]2CCCCN2)c1
InChIInChI=1S/C9H13NS/c1-2-6-10-8(4-1)9-5-3-7-11-9/h3,5,7-8,10H,1-2,4,6H2/t8-/m0/s1
InChIKeyIRHBPLJGCWXMPV-QMMMGPOBSA-N
XLogP2.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-thiophen-2-ylaziridine
CID 55263035
(2R)-2-(5-bromothiophen-2-yl)piperidine
CID 7048175
(2R)-2-(5-methylthiophen-2-yl)piperidine
CID 7048171
(2S)-2-phenylpiperidine
CID 10997356
2-methyl-5-thiophen-2-yl-1,4-oxazepane
CID 83218118
2-(5-methoxythiophen-2-yl)piperidine
CID 130164086
2-(3-thiophen-2-yl-1H-1,2,4-triazol-5-yl)azocane
CID 114239965
2-thiophen-2-ylpiperidine-3-carboxylic acid
CID 112716942
(2S)-2-(thiophen-2-ylmethyl)azepane
CID 94481267
2-(5-methyl-4-thiophen-2-yl-1H-imidazol-2-yl)piperidine
CID 61335496
3-[(2S)-piperidin-2-yl]thiophen-2-amine
CID 130664785
2-[(2R)-piperidin-2-yl]benzene-1,3-diol
CID 130679710

Frequently Asked Questions

What is the IUPAC name of (2S)-2-thiophen-2-ylpiperidine?
The IUPAC name of (2S)-2-thiophen-2-ylpiperidine (CID 7022116) is (2S)-2-thiophen-2-ylpiperidine.
What is the SMILES notation for (2S)-2-thiophen-2-ylpiperidine?
The canonical SMILES for (2S)-2-thiophen-2-ylpiperidine is c1csc([C@@H]2CCCCN2)c1.
What is the InChIKey of (2S)-2-thiophen-2-ylpiperidine?
The InChIKey is IRHBPLJGCWXMPV-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H13NS/c1-2-6-10-8(4-1)9-5-3-7-11-9/h3,5,7-8,10H,1-2,4,6H2/t8-/m0/s1.
What are the key properties of (2S)-2-thiophen-2-ylpiperidine?
(2S)-2-thiophen-2-ylpiperidine has a molecular weight of 167.28 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-thiophen-2-ylpiperidine is sourced from PubChem (CID 7022116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).