(5-phenylthiomorpholin-3-yl)methanol

C11H15NOS — CID 54594302

IUPAC(5-phenylthiomorpholin-3-yl)methanol
SMILESOCC1CSCC(c2ccccc2)N1
InChIInChI=1S/C11H15NOS/c13-6-10-7-14-8-11(12-10)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2
InChIKeyUWFUIBSJCDOJPV-UHFFFAOYSA-N
MW209.31 g/mol
LogP1.42
Rot. Bonds2

About (5-phenylthiomorpholin-3-yl)methanol

(5-phenylthiomorpholin-3-yl)methanol (PubChem CID 54594302) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is (5-phenylthiomorpholin-3-yl)methanol.

Molecular Properties

Compound Name(5-phenylthiomorpholin-3-yl)methanol
PubChem CID54594302
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name(5-phenylthiomorpholin-3-yl)methanol
SMILESOCC1CSCC(c2ccccc2)N1
InChIInChI=1S/C11H15NOS/c13-6-10-7-14-8-11(12-10)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2
InChIKeyUWFUIBSJCDOJPV-UHFFFAOYSA-N
XLogP1.42
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-phenylthiomorpholin-3-yl)methanol?
The IUPAC name of (5-phenylthiomorpholin-3-yl)methanol (CID 54594302) is (5-phenylthiomorpholin-3-yl)methanol.
What is the SMILES notation for (5-phenylthiomorpholin-3-yl)methanol?
The canonical SMILES for (5-phenylthiomorpholin-3-yl)methanol is OCC1CSCC(c2ccccc2)N1.
What is the InChIKey of (5-phenylthiomorpholin-3-yl)methanol?
The InChIKey is UWFUIBSJCDOJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c13-6-10-7-14-8-11(12-10)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2.
What are the key properties of (5-phenylthiomorpholin-3-yl)methanol?
(5-phenylthiomorpholin-3-yl)methanol has a molecular weight of 209.31 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-phenylthiomorpholin-3-yl)methanol is sourced from PubChem (CID 54594302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).