10-piperidin-4-ylphenothiazine

C17H18N2S — CID 58293865

IUPAC10-piperidin-4-ylphenothiazine
SMILESc1ccc2c(c1)Sc1ccccc1N2C1CCNCC1
InChIInChI=1S/C17H18N2S/c1-3-7-16-14(5-1)19(13-9-11-18-12-10-13)15-6-2-4-8-17(15)20-16/h1-8,13,18H,9-12H2
InChIKeyMGYOTKXIKZBTII-UHFFFAOYSA-N
MW282.41 g/mol
LogP4.04
Rot. Bonds1

About 10-piperidin-4-ylphenothiazine

10-piperidin-4-ylphenothiazine (PubChem CID 58293865) has the molecular formula C17H18N2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 10-piperidin-4-ylphenothiazine.

Molecular Properties

Compound Name10-piperidin-4-ylphenothiazine
PubChem CID58293865
Molecular FormulaC17H18N2S
Molecular Weight282.41 g/mol
Exact Mass282.12
IUPAC Name10-piperidin-4-ylphenothiazine
SMILESc1ccc2c(c1)Sc1ccccc1N2C1CCNCC1
InChIInChI=1S/C17H18N2S/c1-3-7-16-14(5-1)19(13-9-11-18-12-10-13)15-6-2-4-8-17(15)20-16/h1-8,13,18H,9-12H2
InChIKeyMGYOTKXIKZBTII-UHFFFAOYSA-N
XLogP4.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-piperidin-4-yl-1,4-benzothiazin-3-one;hydrochloride
CID 22914728
10-[(4R)-azepan-4-yl]-3,7-dichlorophenothiazine
CID 138493763
10-(2-methylcyclopropyl)phenothiazine
CID 59112633
1-piperidin-4-yl-3,4-dihydroquinoline-2-thione
CID 18960737
3-amino-1-piperidin-4-yl-3H-indol-2-one
CID 174586562
4-phenyl-1-piperidin-4-yl-3,4-dihydroquinazolin-2-one
CID 19423615
1-piperidin-4-yl-4H-3,1-benzoxazin-2-one
CID 10704740
10-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenothiazine-3-carbonitrile
CID 59814731
N-(3-phenothiazin-10-ylpropyl)piperidine-4-carboxamide
CID 119293982
5-piperidin-4-ylbenzo[b][1,4]benzoxazepin-6-one
CID 20517736
10-(piperidin-3-ylmethyl)phenothiazine;hydrochloride
CID 146675496
(2R)-2-amino-6-phenothiazin-10-ylcyclohexan-1-ol
CID 137467471

Frequently Asked Questions

What is the IUPAC name of 10-piperidin-4-ylphenothiazine?
The IUPAC name of 10-piperidin-4-ylphenothiazine (CID 58293865) is 10-piperidin-4-ylphenothiazine.
What is the SMILES notation for 10-piperidin-4-ylphenothiazine?
The canonical SMILES for 10-piperidin-4-ylphenothiazine is c1ccc2c(c1)Sc1ccccc1N2C1CCNCC1.
What is the InChIKey of 10-piperidin-4-ylphenothiazine?
The InChIKey is MGYOTKXIKZBTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2S/c1-3-7-16-14(5-1)19(13-9-11-18-12-10-13)15-6-2-4-8-17(15)20-16/h1-8,13,18H,9-12H2.
What are the key properties of 10-piperidin-4-ylphenothiazine?
10-piperidin-4-ylphenothiazine has a molecular weight of 282.41 g/mol, XLogP of 4.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-piperidin-4-ylphenothiazine is sourced from PubChem (CID 58293865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).