[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol

C11H21NO5S — CID 81218861

IUPAC[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol
SMILESCC1COC(CO)CN1S(=O)(=O)CC1CCCO1
InChIInChI=1S/C11H21NO5S/c1-9-7-17-11(6-13)5-12(9)18(14,15)8-10-3-2-4-16-10/h9-11,13H,2-8H2,1H3
InChIKeyDIHQYWNDEAICTP-UHFFFAOYSA-N
MW279.36 g/mol
LogP-0.42
Rot. Bonds4

About [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol

[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol (PubChem CID 81218861) has the molecular formula C11H21NO5S and a molecular weight of 279.36 g/mol. Its IUPAC name is [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol.

Molecular Properties

Compound Name[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol
PubChem CID81218861
Molecular FormulaC11H21NO5S
Molecular Weight279.36 g/mol
Exact Mass279.11
IUPAC Name[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol
SMILESCC1COC(CO)CN1S(=O)(=O)CC1CCCO1
InChIInChI=1S/C11H21NO5S/c1-9-7-17-11(6-13)5-12(9)18(14,15)8-10-3-2-4-16-10/h9-11,13H,2-8H2,1H3
InChIKeyDIHQYWNDEAICTP-UHFFFAOYSA-N
XLogP-0.42
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 5-0.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanamine
CID 81217702
2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]sulfonylacetic acid
CID 81202826
2-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidine-4-carboxylic acid
CID 106742431
(5-methyl-4-propan-2-ylsulfonylmorpholin-2-yl)methanol
CID 81219426
[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-(oxolan-2-yl)methanone
CID 81208731
1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-2-(oxan-2-yl)ethanone
CID 81208543
2-(hydroxymethyl)-5-methyl-N-propylmorpholine-4-sulfonamide
CID 114809725
2-(chloromethyl)-6-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholine
CID 102938021
methanol;[(2S)-oxolan-2-yl]methanol
CID 144618761
calcium;hydride;oxolan-2-ylmethanol
CID 173198677
(2R)-2-ethyloxolane
CID 641529
1-(oxolan-2-ylmethylsulfonyl)pyrrolidin-3-ol
CID 63247301

Frequently Asked Questions

What is the IUPAC name of [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol?
The IUPAC name of [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol (CID 81218861) is [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol.
What is the SMILES notation for [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol?
The canonical SMILES for [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol is CC1COC(CO)CN1S(=O)(=O)CC1CCCO1.
What is the InChIKey of [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol?
The InChIKey is DIHQYWNDEAICTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO5S/c1-9-7-17-11(6-13)5-12(9)18(14,15)8-10-3-2-4-16-10/h9-11,13H,2-8H2,1H3.
What are the key properties of [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol?
[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol has a molecular weight of 279.36 g/mol, XLogP of -0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanol is sourced from PubChem (CID 81218861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).