1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol

C11H21NOS — CID 65212845

IUPAC1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol
SMILESCC1CSCCN1CC1(O)CCCC1
InChIInChI=1S/C11H21NOS/c1-10-8-14-7-6-12(10)9-11(13)4-2-3-5-11/h10,13H,2-9H2,1H3
InChIKeyUZAXOKJAPAYLIC-UHFFFAOYSA-N
MW215.36 g/mol
LogP1.73
Rot. Bonds2

About 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol

1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol (PubChem CID 65212845) has the molecular formula C11H21NOS and a molecular weight of 215.36 g/mol. Its IUPAC name is 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol
PubChem CID65212845
Molecular FormulaC11H21NOS
Molecular Weight215.36 g/mol
Exact Mass215.13
IUPAC Name1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol
SMILESCC1CSCCN1CC1(O)CCCC1
InChIInChI=1S/C11H21NOS/c1-10-8-14-7-6-12(10)9-11(13)4-2-3-5-11/h10,13H,2-9H2,1H3
InChIKeyUZAXOKJAPAYLIC-UHFFFAOYSA-N
XLogP1.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
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 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol (CID 65212845) is 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol is CC1CSCCN1CC1(O)CCCC1.
What is the InChIKey of 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol?
The InChIKey is UZAXOKJAPAYLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOS/c1-10-8-14-7-6-12(10)9-11(13)4-2-3-5-11/h10,13H,2-9H2,1H3.
What are the key properties of 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol?
1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol has a molecular weight of 215.36 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methylthiomorpholin-4-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65212845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).