phenothiazin-10-yl(piperidin-1-yl)methanone

C18H18N2OS — CID 705775

IUPACphenothiazin-10-yl(piperidin-1-yl)methanone
SMILESO=C(N1CCCCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C18H18N2OS/c21-18(19-12-6-1-7-13-19)20-14-8-2-4-10-16(14)22-17-11-5-3-9-15(17)20/h2-5,8-11H,1,6-7,12-13H2
InChIKeyZYAXTAFPNAMCKA-UHFFFAOYSA-N
MW310.42 g/mol
LogP4.90
Rot. Bonds

About phenothiazin-10-yl(piperidin-1-yl)methanone

phenothiazin-10-yl(piperidin-1-yl)methanone (PubChem CID 705775) has the molecular formula C18H18N2OS and a molecular weight of 310.42 g/mol. Its IUPAC name is phenothiazin-10-yl(piperidin-1-yl)methanone.

Molecular Properties

Compound Namephenothiazin-10-yl(piperidin-1-yl)methanone
PubChem CID705775
Molecular FormulaC18H18N2OS
Molecular Weight310.42 g/mol
Exact Mass310.11
IUPAC Namephenothiazin-10-yl(piperidin-1-yl)methanone
SMILESO=C(N1CCCCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C18H18N2OS/c21-18(19-12-6-1-7-13-19)20-14-8-2-4-10-16(14)22-17-11-5-3-9-15(17)20/h2-5,8-11H,1,6-7,12-13H2
InChIKeyZYAXTAFPNAMCKA-UHFFFAOYSA-N
XLogP4.90
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze phenothiazin-10-yl(piperidin-1-yl)methanone with MolForge

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

Launch Full Analysis

Related Compounds

Promethazine
CID 4927
(+-)-Trimeprazine
CID 5574
Promazine
CID 4926
Promazine Hydrochloride
CID 5887
Perazine
CID 4744
(+-)-Ethopropazine
CID 3290
Pecazine
CID 6075
Fenethazine
CID 68223
Diethazine
CID 65535
N-propan-2-ylphenothiazine-10-carboxamide
CID 704259
2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone
CID 69500
N,N-diethyl-10H-phenothiazine-10-carboxamide
CID 705771

Frequently Asked Questions

What is the IUPAC name of phenothiazin-10-yl(piperidin-1-yl)methanone?
The IUPAC name of phenothiazin-10-yl(piperidin-1-yl)methanone (CID 705775) is phenothiazin-10-yl(piperidin-1-yl)methanone.
What is the SMILES notation for phenothiazin-10-yl(piperidin-1-yl)methanone?
The canonical SMILES for phenothiazin-10-yl(piperidin-1-yl)methanone is O=C(N1CCCCC1)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of phenothiazin-10-yl(piperidin-1-yl)methanone?
The InChIKey is ZYAXTAFPNAMCKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2OS/c21-18(19-12-6-1-7-13-19)20-14-8-2-4-10-16(14)22-17-11-5-3-9-15(17)20/h2-5,8-11H,1,6-7,12-13H2.
What are the key properties of phenothiazin-10-yl(piperidin-1-yl)methanone?
phenothiazin-10-yl(piperidin-1-yl)methanone has a molecular weight of 310.42 g/mol, XLogP of 4.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenothiazin-10-yl(piperidin-1-yl)methanone is sourced from PubChem (CID 705775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).