1-(2,3-dihydrothiophen-4-yl)piperidine

C9H15NS — CID 14838733

IUPAC1-(2,3-dihydrothiophen-4-yl)piperidine
SMILESC1=C(N2CCCCC2)CCS1
InChIInChI=1S/C9H15NS/c1-2-5-10(6-3-1)9-4-7-11-8-9/h8H,1-7H2
InChIKeyGIGHUMDNTFFIKD-UHFFFAOYSA-N
MW169.29 g/mol
LogP2.45
Rot. Bonds1

About 1-(2,3-dihydrothiophen-4-yl)piperidine

1-(2,3-dihydrothiophen-4-yl)piperidine (PubChem CID 14838733) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is 1-(2,3-dihydrothiophen-4-yl)piperidine.

Molecular Properties

Compound Name1-(2,3-dihydrothiophen-4-yl)piperidine
PubChem CID14838733
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC Name1-(2,3-dihydrothiophen-4-yl)piperidine
SMILESC1=C(N2CCCCC2)CCS1
InChIInChI=1S/C9H15NS/c1-2-5-10(6-3-1)9-4-7-11-8-9/h8H,1-7H2
InChIKeyGIGHUMDNTFFIKD-UHFFFAOYSA-N
XLogP2.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrothiophen-4-yl)piperidine?
The IUPAC name of 1-(2,3-dihydrothiophen-4-yl)piperidine (CID 14838733) is 1-(2,3-dihydrothiophen-4-yl)piperidine.
What is the SMILES notation for 1-(2,3-dihydrothiophen-4-yl)piperidine?
The canonical SMILES for 1-(2,3-dihydrothiophen-4-yl)piperidine is C1=C(N2CCCCC2)CCS1.
What is the InChIKey of 1-(2,3-dihydrothiophen-4-yl)piperidine?
The InChIKey is GIGHUMDNTFFIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-2-5-10(6-3-1)9-4-7-11-8-9/h8H,1-7H2.
What are the key properties of 1-(2,3-dihydrothiophen-4-yl)piperidine?
1-(2,3-dihydrothiophen-4-yl)piperidine has a molecular weight of 169.29 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrothiophen-4-yl)piperidine is sourced from PubChem (CID 14838733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).