4-(2,3-dihydrothiophen-3-yl)piperidine

C9H15NS — CID 142892711

IUPAC4-(2,3-dihydrothiophen-3-yl)piperidine
SMILESC1=CC(C2CCNCC2)CS1
InChIInChI=1S/C9H15NS/c1-4-10-5-2-8(1)9-3-6-11-7-9/h3,6,8-10H,1-2,4-5,7H2
InChIKeyAENMZFJJALKBSG-UHFFFAOYSA-N
MW169.29 g/mol
LogP1.86
Rot. Bonds1

About 4-(2,3-dihydrothiophen-3-yl)piperidine

4-(2,3-dihydrothiophen-3-yl)piperidine (PubChem CID 142892711) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is 4-(2,3-dihydrothiophen-3-yl)piperidine.

Molecular Properties

Compound Name4-(2,3-dihydrothiophen-3-yl)piperidine
PubChem CID142892711
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC Name4-(2,3-dihydrothiophen-3-yl)piperidine
SMILESC1=CC(C2CCNCC2)CS1
InChIInChI=1S/C9H15NS/c1-4-10-5-2-8(1)9-3-6-11-7-9/h3,6,8-10H,1-2,4-5,7H2
InChIKeyAENMZFJJALKBSG-UHFFFAOYSA-N
XLogP1.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydrothiophen-3-yl)piperidine?
The IUPAC name of 4-(2,3-dihydrothiophen-3-yl)piperidine (CID 142892711) is 4-(2,3-dihydrothiophen-3-yl)piperidine.
What is the SMILES notation for 4-(2,3-dihydrothiophen-3-yl)piperidine?
The canonical SMILES for 4-(2,3-dihydrothiophen-3-yl)piperidine is C1=CC(C2CCNCC2)CS1.
What is the InChIKey of 4-(2,3-dihydrothiophen-3-yl)piperidine?
The InChIKey is AENMZFJJALKBSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-4-10-5-2-8(1)9-3-6-11-7-9/h3,6,8-10H,1-2,4-5,7H2.
What are the key properties of 4-(2,3-dihydrothiophen-3-yl)piperidine?
4-(2,3-dihydrothiophen-3-yl)piperidine has a molecular weight of 169.29 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydrothiophen-3-yl)piperidine is sourced from PubChem (CID 142892711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).