[4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol

C11H15FN2O4S — CID 103300552

IUPAC[4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(S(=O)(=O)c2ncccc2F)CC(CO)O1
InChIInChI=1S/C11H15FN2O4S/c1-8-5-14(6-9(7-15)18-8)19(16,17)11-10(12)3-2-4-13-11/h2-4,8-9,15H,5-7H2,1H3
InChIKeyCPULSUCKJNAVSS-UHFFFAOYSA-N
MW290.32 g/mol
LogP-0.01
Rot. Bonds3

About [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol

[4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 103300552) has the molecular formula C11H15FN2O4S and a molecular weight of 290.32 g/mol. Its IUPAC name is [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol
PubChem CID103300552
Molecular FormulaC11H15FN2O4S
Molecular Weight290.32 g/mol
Exact Mass290.07
IUPAC Name[4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(S(=O)(=O)c2ncccc2F)CC(CO)O1
InChIInChI=1S/C11H15FN2O4S/c1-8-5-14(6-9(7-15)18-8)19(16,17)11-10(12)3-2-4-13-11/h2-4,8-9,15H,5-7H2,1H3
InChIKeyCPULSUCKJNAVSS-UHFFFAOYSA-N
XLogP-0.01
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol (CID 103300552) is [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol is CC1CN(S(=O)(=O)c2ncccc2F)CC(CO)O1.
What is the InChIKey of [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is CPULSUCKJNAVSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O4S/c1-8-5-14(6-9(7-15)18-8)19(16,17)11-10(12)3-2-4-13-11/h2-4,8-9,15H,5-7H2,1H3.
What are the key properties of [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol?
[4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 290.32 g/mol, XLogP of -0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-fluoro-2-pyridinyl)sulfonyl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 103300552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).