2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine

C13H21NS — CID 138708345

IUPAC2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine
SMILESCC1(C)CCCC(C)(C)N1c1cccs1
InChIInChI=1S/C13H21NS/c1-12(2)8-6-9-13(3,4)14(12)11-7-5-10-15-11/h5,7,10H,6,8-9H2,1-4H3
InChIKeyVGPYTHGJBSITQM-UHFFFAOYSA-N
MW223.38 g/mol
LogP4.30
Rot. Bonds1

About 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine

2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine (PubChem CID 138708345) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine
PubChem CID138708345
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC Name2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine
SMILESCC1(C)CCCC(C)(C)N1c1cccs1
InChIInChI=1S/C13H21NS/c1-12(2)8-6-9-13(3,4)14(12)11-7-5-10-15-11/h5,7,10H,6,8-9H2,1-4H3
InChIKeyVGPYTHGJBSITQM-UHFFFAOYSA-N
XLogP4.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine?
The IUPAC name of 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine (CID 138708345) is 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine is CC1(C)CCCC(C)(C)N1c1cccs1.
What is the InChIKey of 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine?
The InChIKey is VGPYTHGJBSITQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-12(2)8-6-9-13(3,4)14(12)11-7-5-10-15-11/h5,7,10H,6,8-9H2,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine?
2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine has a molecular weight of 223.38 g/mol, XLogP of 4.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-1-thiophen-2-ylpiperidine is sourced from PubChem (CID 138708345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).