4-(4-ethylpiperidin-4-yl)thiomorpholine

C11H22N2S — CID 165471262

IUPAC4-(4-ethylpiperidin-4-yl)thiomorpholine
SMILESCCC1(N2CCSCC2)CCNCC1
InChIInChI=1S/C11H22N2S/c1-2-11(3-5-12-6-4-11)13-7-9-14-10-8-13/h12H,2-10H2,1H3
InChIKeySNHBGRUAGAYJRB-UHFFFAOYSA-N
MW214.38 g/mol
LogP1.57
Rot. Bonds2

About 4-(4-ethylpiperidin-4-yl)thiomorpholine

4-(4-ethylpiperidin-4-yl)thiomorpholine (PubChem CID 165471262) has the molecular formula C11H22N2S and a molecular weight of 214.38 g/mol. Its IUPAC name is 4-(4-ethylpiperidin-4-yl)thiomorpholine.

Molecular Properties

Compound Name4-(4-ethylpiperidin-4-yl)thiomorpholine
PubChem CID165471262
Molecular FormulaC11H22N2S
Molecular Weight214.38 g/mol
Exact Mass214.15
IUPAC Name4-(4-ethylpiperidin-4-yl)thiomorpholine
SMILESCCC1(N2CCSCC2)CCNCC1
InChIInChI=1S/C11H22N2S/c1-2-11(3-5-12-6-4-11)13-7-9-14-10-8-13/h12H,2-10H2,1H3
InChIKeySNHBGRUAGAYJRB-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylpiperidin-4-yl)thiomorpholine?
The IUPAC name of 4-(4-ethylpiperidin-4-yl)thiomorpholine (CID 165471262) is 4-(4-ethylpiperidin-4-yl)thiomorpholine.
What is the SMILES notation for 4-(4-ethylpiperidin-4-yl)thiomorpholine?
The canonical SMILES for 4-(4-ethylpiperidin-4-yl)thiomorpholine is CCC1(N2CCSCC2)CCNCC1.
What is the InChIKey of 4-(4-ethylpiperidin-4-yl)thiomorpholine?
The InChIKey is SNHBGRUAGAYJRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2S/c1-2-11(3-5-12-6-4-11)13-7-9-14-10-8-13/h12H,2-10H2,1H3.
What are the key properties of 4-(4-ethylpiperidin-4-yl)thiomorpholine?
4-(4-ethylpiperidin-4-yl)thiomorpholine has a molecular weight of 214.38 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylpiperidin-4-yl)thiomorpholine is sourced from PubChem (CID 165471262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).