(4-methylsulfinylmorpholin-3-yl)methanol

C6H13NO3S — CID 127006204

IUPAC(4-methylsulfinylmorpholin-3-yl)methanol
SMILESCS(=O)N1CCOCC1CO
InChIInChI=1S/C6H13NO3S/c1-11(9)7-2-3-10-5-6(7)4-8/h6,8H,2-5H2,1H3
InChIKeyGVYCYKIEDIJCKW-UHFFFAOYSA-N
MW179.24 g/mol
LogP-1.03
Rot. Bonds2

About (4-methylsulfinylmorpholin-3-yl)methanol

(4-methylsulfinylmorpholin-3-yl)methanol (PubChem CID 127006204) has the molecular formula C6H13NO3S and a molecular weight of 179.24 g/mol. Its IUPAC name is (4-methylsulfinylmorpholin-3-yl)methanol.

Molecular Properties

Compound Name(4-methylsulfinylmorpholin-3-yl)methanol
PubChem CID127006204
Molecular FormulaC6H13NO3S
Molecular Weight179.24 g/mol
Exact Mass179.06
IUPAC Name(4-methylsulfinylmorpholin-3-yl)methanol
SMILESCS(=O)N1CCOCC1CO
InChIInChI=1S/C6H13NO3S/c1-11(9)7-2-3-10-5-6(7)4-8/h6,8H,2-5H2,1H3
InChIKeyGVYCYKIEDIJCKW-UHFFFAOYSA-N
XLogP-1.03
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 5-1.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-4-methylmorpholin-3-yl]methanol
CID 58666450
3-(hydroxymethyl)morpholine-4-carbaldehyde
CID 87595725
[4-(sulfanylmethyl)morpholin-3-yl]methanol
CID 139499999
2-[3-(hydroxymethyl)morpholin-4-yl]ethanol
CID 83815724
(2,2-dimethylcyclopropyl)-[3-(hydroxymethyl)morpholin-4-yl]methanone
CID 107002178
[3-(hydroxymethyl)morpholin-4-yl]-(1-propan-2-ylpiperidin-4-yl)methanone
CID 70650528
[4-[2-(methylamino)ethyl]morpholin-3-yl]methanol
CID 83816538
3-(hydroxymethyl)-N-propylmorpholine-4-sulfonamide
CID 114809867
2-[3-(hydroxymethyl)morpholin-4-yl]acetonitrile
CID 83815490
[(6R)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-6-yl]methanol;ethane
CID 177330814
[4-(4-methoxyphenyl)morpholin-3-yl]methanol
CID 117009227
2-[(3S)-4-methylmorpholin-3-yl]ethanol
CID 155290392

Frequently Asked Questions

What is the IUPAC name of (4-methylsulfinylmorpholin-3-yl)methanol?
The IUPAC name of (4-methylsulfinylmorpholin-3-yl)methanol (CID 127006204) is (4-methylsulfinylmorpholin-3-yl)methanol.
What is the SMILES notation for (4-methylsulfinylmorpholin-3-yl)methanol?
The canonical SMILES for (4-methylsulfinylmorpholin-3-yl)methanol is CS(=O)N1CCOCC1CO.
What is the InChIKey of (4-methylsulfinylmorpholin-3-yl)methanol?
The InChIKey is GVYCYKIEDIJCKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3S/c1-11(9)7-2-3-10-5-6(7)4-8/h6,8H,2-5H2,1H3.
What are the key properties of (4-methylsulfinylmorpholin-3-yl)methanol?
(4-methylsulfinylmorpholin-3-yl)methanol has a molecular weight of 179.24 g/mol, XLogP of -1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylsulfinylmorpholin-3-yl)methanol is sourced from PubChem (CID 127006204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).