2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride

C14H15ClN2OS — CID 45262855

IUPAC2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride
SMILESCl.NCCOc1ccc2c(c1)Nc1ccccc1S2
InChIInChI=1S/C14H14N2OS.ClH/c15-7-8-17-10-5-6-14-12(9-10)16-11-3-1-2-4-13(11)18-14;/h1-6,9,16H,7-8,15H2;1H
InChIKeyLYOXIIXNXJCYTI-UHFFFAOYSA-N
MW294.81 g/mol
LogP3.65
Rot. Bonds3

About 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride

2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride (PubChem CID 45262855) has the molecular formula C14H15ClN2OS and a molecular weight of 294.81 g/mol. Its IUPAC name is 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride
PubChem CID45262855
Molecular FormulaC14H15ClN2OS
Molecular Weight294.81 g/mol
Exact Mass294.06
IUPAC Name2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride
SMILESCl.NCCOc1ccc2c(c1)Nc1ccccc1S2
InChIInChI=1S/C14H14N2OS.ClH/c15-7-8-17-10-5-6-14-12(9-10)16-11-3-1-2-4-13(11)18-14;/h1-6,9,16H,7-8,15H2;1H
InChIKeyLYOXIIXNXJCYTI-UHFFFAOYSA-N
XLogP3.65
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.81
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride 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 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride?
The IUPAC name of 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride (CID 45262855) is 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride.
What is the SMILES notation for 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride?
The canonical SMILES for 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride is Cl.NCCOc1ccc2c(c1)Nc1ccccc1S2.
What is the InChIKey of 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride?
The InChIKey is LYOXIIXNXJCYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2OS.ClH/c15-7-8-17-10-5-6-14-12(9-10)16-11-3-1-2-4-13(11)18-14;/h1-6,9,16H,7-8,15H2;1H.
What are the key properties of 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride?
2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride has a molecular weight of 294.81 g/mol, XLogP of 3.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(10H-phenothiazin-2-yloxy)ethanamine;hydrochloride is sourced from PubChem (CID 45262855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).