2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol

C11H21NOS — CID 115772947

IUPAC2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol
SMILESCC1(C)CN(C2CCCC2O)CCS1
InChIInChI=1S/C11H21NOS/c1-11(2)8-12(6-7-14-11)9-4-3-5-10(9)13/h9-10,13H,3-8H2,1-2H3
InChIKeyYGANNIAMFMFXBP-UHFFFAOYSA-N
MW215.36 g/mol
LogP1.73
Rot. Bonds1

About 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol

2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol (PubChem CID 115772947) has the molecular formula C11H21NOS and a molecular weight of 215.36 g/mol. Its IUPAC name is 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol
PubChem CID115772947
Molecular FormulaC11H21NOS
Molecular Weight215.36 g/mol
Exact Mass215.13
IUPAC Name2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol
SMILESCC1(C)CN(C2CCCC2O)CCS1
InChIInChI=1S/C11H21NOS/c1-11(2)8-12(6-7-14-11)9-4-3-5-10(9)13/h9-10,13H,3-8H2,1-2H3
InChIKeyYGANNIAMFMFXBP-UHFFFAOYSA-N
XLogP1.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol?
The IUPAC name of 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol (CID 115772947) is 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol.
What is the SMILES notation for 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol?
The canonical SMILES for 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol is CC1(C)CN(C2CCCC2O)CCS1.
What is the InChIKey of 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol?
The InChIKey is YGANNIAMFMFXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOS/c1-11(2)8-12(6-7-14-11)9-4-3-5-10(9)13/h9-10,13H,3-8H2,1-2H3.
What are the key properties of 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol?
2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol has a molecular weight of 215.36 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylthiomorpholin-4-yl)cyclopentan-1-ol is sourced from PubChem (CID 115772947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).