7-methoxy-N,10-dimethylphenothiazin-3-amine

C15H16N2OS — CID 70686558

IUPAC7-methoxy-N,10-dimethylphenothiazin-3-amine
SMILESCNc1ccc2c(c1)Sc1cc(OC)ccc1N2C
InChIInChI=1S/C15H16N2OS/c1-16-10-4-6-12-14(8-10)19-15-9-11(18-3)5-7-13(15)17(12)2/h4-9,16H,1-3H3
InChIKeyPGBZVCNYBQZMLZ-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.97
Rot. Bonds2

About 7-methoxy-N,10-dimethylphenothiazin-3-amine

7-methoxy-N,10-dimethylphenothiazin-3-amine (PubChem CID 70686558) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 7-methoxy-N,10-dimethylphenothiazin-3-amine.

Molecular Properties

Compound Name7-methoxy-N,10-dimethylphenothiazin-3-amine
PubChem CID70686558
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name7-methoxy-N,10-dimethylphenothiazin-3-amine
SMILESCNc1ccc2c(c1)Sc1cc(OC)ccc1N2C
InChIInChI=1S/C15H16N2OS/c1-16-10-4-6-12-14(8-10)19-15-9-11(18-3)5-7-13(15)17(12)2/h4-9,16H,1-3H3
InChIKeyPGBZVCNYBQZMLZ-UHFFFAOYSA-N
XLogP3.97
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N,10-dimethylphenothiazin-3-amine?
The IUPAC name of 7-methoxy-N,10-dimethylphenothiazin-3-amine (CID 70686558) is 7-methoxy-N,10-dimethylphenothiazin-3-amine.
What is the SMILES notation for 7-methoxy-N,10-dimethylphenothiazin-3-amine?
The canonical SMILES for 7-methoxy-N,10-dimethylphenothiazin-3-amine is CNc1ccc2c(c1)Sc1cc(OC)ccc1N2C.
What is the InChIKey of 7-methoxy-N,10-dimethylphenothiazin-3-amine?
The InChIKey is PGBZVCNYBQZMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-16-10-4-6-12-14(8-10)19-15-9-11(18-3)5-7-13(15)17(12)2/h4-9,16H,1-3H3.
What are the key properties of 7-methoxy-N,10-dimethylphenothiazin-3-amine?
7-methoxy-N,10-dimethylphenothiazin-3-amine has a molecular weight of 272.37 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N,10-dimethylphenothiazin-3-amine is sourced from PubChem (CID 70686558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).