(3-morpholin-4-ylsulfonylphenyl)methanol

C11H15NO4S — CID 2452209

IUPAC(3-morpholin-4-ylsulfonylphenyl)methanol
SMILESO=S(=O)(c1cccc(CO)c1)N1CCOCC1
InChIInChI=1S/C11H15NO4S/c13-9-10-2-1-3-11(8-10)17(14,15)12-4-6-16-7-5-12/h1-3,8,13H,4-7,9H2
InChIKeyPTHYGSUCUYDAKW-UHFFFAOYSA-N
MW257.31 g/mol
LogP0.20
Rot. Bonds3

About (3-morpholin-4-ylsulfonylphenyl)methanol

(3-morpholin-4-ylsulfonylphenyl)methanol (PubChem CID 2452209) has the molecular formula C11H15NO4S and a molecular weight of 257.31 g/mol. Its IUPAC name is (3-morpholin-4-ylsulfonylphenyl)methanol.

Molecular Properties

Compound Name(3-morpholin-4-ylsulfonylphenyl)methanol
PubChem CID2452209
Molecular FormulaC11H15NO4S
Molecular Weight257.31 g/mol
Exact Mass257.07
IUPAC Name(3-morpholin-4-ylsulfonylphenyl)methanol
SMILESO=S(=O)(c1cccc(CO)c1)N1CCOCC1
InChIInChI=1S/C11H15NO4S/c13-9-10-2-1-3-11(8-10)17(14,15)12-4-6-16-7-5-12/h1-3,8,13H,4-7,9H2
InChIKeyPTHYGSUCUYDAKW-UHFFFAOYSA-N
XLogP0.20
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-morpholin-4-ylsulfonylphenyl)methanol?
The IUPAC name of (3-morpholin-4-ylsulfonylphenyl)methanol (CID 2452209) is (3-morpholin-4-ylsulfonylphenyl)methanol.
What is the SMILES notation for (3-morpholin-4-ylsulfonylphenyl)methanol?
The canonical SMILES for (3-morpholin-4-ylsulfonylphenyl)methanol is O=S(=O)(c1cccc(CO)c1)N1CCOCC1.
What is the InChIKey of (3-morpholin-4-ylsulfonylphenyl)methanol?
The InChIKey is PTHYGSUCUYDAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4S/c13-9-10-2-1-3-11(8-10)17(14,15)12-4-6-16-7-5-12/h1-3,8,13H,4-7,9H2.
What are the key properties of (3-morpholin-4-ylsulfonylphenyl)methanol?
(3-morpholin-4-ylsulfonylphenyl)methanol has a molecular weight of 257.31 g/mol, XLogP of 0.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-morpholin-4-ylsulfonylphenyl)methanol is sourced from PubChem (CID 2452209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).