3-ethoxy-7-methyl-10H-phenothiazine

C15H15NOS — CID 71404367

IUPAC3-ethoxy-7-methyl-10H-phenothiazine
SMILESCCOc1ccc2c(c1)Sc1cc(C)ccc1N2
InChIInChI=1S/C15H15NOS/c1-3-17-11-5-7-13-15(9-11)18-14-8-10(2)4-6-12(14)16-13/h4-9,16H,3H2,1-2H3
InChIKeyGOUYCVWSHDHSNX-UHFFFAOYSA-N
MW257.36 g/mol
LogP4.60
Rot. Bonds2

About 3-ethoxy-7-methyl-10H-phenothiazine

3-ethoxy-7-methyl-10H-phenothiazine (PubChem CID 71404367) has the molecular formula C15H15NOS and a molecular weight of 257.36 g/mol. Its IUPAC name is 3-ethoxy-7-methyl-10H-phenothiazine.

Molecular Properties

Compound Name3-ethoxy-7-methyl-10H-phenothiazine
PubChem CID71404367
Molecular FormulaC15H15NOS
Molecular Weight257.36 g/mol
Exact Mass257.09
IUPAC Name3-ethoxy-7-methyl-10H-phenothiazine
SMILESCCOc1ccc2c(c1)Sc1cc(C)ccc1N2
InChIInChI=1S/C15H15NOS/c1-3-17-11-5-7-13-15(9-11)18-14-8-10(2)4-6-12(14)16-13/h4-9,16H,3H2,1-2H3
InChIKeyGOUYCVWSHDHSNX-UHFFFAOYSA-N
XLogP4.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-7-methyl-10H-phenothiazine?
The IUPAC name of 3-ethoxy-7-methyl-10H-phenothiazine (CID 71404367) is 3-ethoxy-7-methyl-10H-phenothiazine.
What is the SMILES notation for 3-ethoxy-7-methyl-10H-phenothiazine?
The canonical SMILES for 3-ethoxy-7-methyl-10H-phenothiazine is CCOc1ccc2c(c1)Sc1cc(C)ccc1N2.
What is the InChIKey of 3-ethoxy-7-methyl-10H-phenothiazine?
The InChIKey is GOUYCVWSHDHSNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NOS/c1-3-17-11-5-7-13-15(9-11)18-14-8-10(2)4-6-12(14)16-13/h4-9,16H,3H2,1-2H3.
What are the key properties of 3-ethoxy-7-methyl-10H-phenothiazine?
3-ethoxy-7-methyl-10H-phenothiazine has a molecular weight of 257.36 g/mol, XLogP of 4.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-7-methyl-10H-phenothiazine is sourced from PubChem (CID 71404367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).