3-amino-1-phenothiazin-10-ylpropan-1-one

C15H14N2OS — CID 608065

IUPAC3-amino-1-phenothiazin-10-ylpropan-1-one
SMILESNCCC(=O)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C15H14N2OS/c16-10-9-15(18)17-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)17/h1-8H,9-10,16H2
InChIKeyFXUBEQZPKFFQBL-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.16
Rot. Bonds2

About 3-amino-1-phenothiazin-10-ylpropan-1-one

3-amino-1-phenothiazin-10-ylpropan-1-one (PubChem CID 608065) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 3-amino-1-phenothiazin-10-ylpropan-1-one.

Molecular Properties

Compound Name3-amino-1-phenothiazin-10-ylpropan-1-one
PubChem CID608065
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name3-amino-1-phenothiazin-10-ylpropan-1-one
SMILESNCCC(=O)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C15H14N2OS/c16-10-9-15(18)17-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)17/h1-8H,9-10,16H2
InChIKeyFXUBEQZPKFFQBL-UHFFFAOYSA-N
XLogP3.16
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-amino-1-phenothiazin-10-ylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-phenothiazin-10-ylpropan-1-one?
The IUPAC name of 3-amino-1-phenothiazin-10-ylpropan-1-one (CID 608065) is 3-amino-1-phenothiazin-10-ylpropan-1-one.
What is the SMILES notation for 3-amino-1-phenothiazin-10-ylpropan-1-one?
The canonical SMILES for 3-amino-1-phenothiazin-10-ylpropan-1-one is NCCC(=O)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of 3-amino-1-phenothiazin-10-ylpropan-1-one?
The InChIKey is FXUBEQZPKFFQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c16-10-9-15(18)17-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)17/h1-8H,9-10,16H2.
What are the key properties of 3-amino-1-phenothiazin-10-ylpropan-1-one?
3-amino-1-phenothiazin-10-ylpropan-1-one has a molecular weight of 270.36 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-phenothiazin-10-ylpropan-1-one is sourced from PubChem (CID 608065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).