(10-ethyl-5-oxophenothiazin-3-yl)methanol

C15H15NO2S — CID 11300274

IUPAC(10-ethyl-5-oxophenothiazin-3-yl)methanol
SMILESCCN1c2ccccc2S(=O)c2cc(CO)ccc21
InChIInChI=1S/C15H15NO2S/c1-2-16-12-5-3-4-6-14(12)19(18)15-9-11(10-17)7-8-13(15)16/h3-9,17H,2,10H2,1H3
InChIKeyQYYFKKBEZKJSCG-UHFFFAOYSA-N
MW273.36 g/mol
LogP2.82
Rot. Bonds2

About (10-ethyl-5-oxophenothiazin-3-yl)methanol

(10-ethyl-5-oxophenothiazin-3-yl)methanol (PubChem CID 11300274) has the molecular formula C15H15NO2S and a molecular weight of 273.36 g/mol. Its IUPAC name is (10-ethyl-5-oxophenothiazin-3-yl)methanol.

Molecular Properties

Compound Name(10-ethyl-5-oxophenothiazin-3-yl)methanol
PubChem CID11300274
Molecular FormulaC15H15NO2S
Molecular Weight273.36 g/mol
Exact Mass273.08
IUPAC Name(10-ethyl-5-oxophenothiazin-3-yl)methanol
SMILESCCN1c2ccccc2S(=O)c2cc(CO)ccc21
InChIInChI=1S/C15H15NO2S/c1-2-16-12-5-3-4-6-14(12)19(18)15-9-11(10-17)7-8-13(15)16/h3-9,17H,2,10H2,1H3
InChIKeyQYYFKKBEZKJSCG-UHFFFAOYSA-N
XLogP2.82
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (10-ethyl-5-oxophenothiazin-3-yl)methanol?
The IUPAC name of (10-ethyl-5-oxophenothiazin-3-yl)methanol (CID 11300274) is (10-ethyl-5-oxophenothiazin-3-yl)methanol.
What is the SMILES notation for (10-ethyl-5-oxophenothiazin-3-yl)methanol?
The canonical SMILES for (10-ethyl-5-oxophenothiazin-3-yl)methanol is CCN1c2ccccc2S(=O)c2cc(CO)ccc21.
What is the InChIKey of (10-ethyl-5-oxophenothiazin-3-yl)methanol?
The InChIKey is QYYFKKBEZKJSCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2S/c1-2-16-12-5-3-4-6-14(12)19(18)15-9-11(10-17)7-8-13(15)16/h3-9,17H,2,10H2,1H3.
What are the key properties of (10-ethyl-5-oxophenothiazin-3-yl)methanol?
(10-ethyl-5-oxophenothiazin-3-yl)methanol has a molecular weight of 273.36 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (10-ethyl-5-oxophenothiazin-3-yl)methanol is sourced from PubChem (CID 11300274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).