morpholin-4-yl(phenothiazin-10-yl)methanone

C17H16N2O2S — CID 705776

IUPACmorpholin-4-yl(phenothiazin-10-yl)methanone
SMILESO=C(N1CCOCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C17H16N2O2S/c20-17(18-9-11-21-12-10-18)19-13-5-1-3-7-15(13)22-16-8-4-2-6-14(16)19/h1-8H,9-12H2
InChIKeyPWLGMYUBQYNSQV-UHFFFAOYSA-N
MW312.39 g/mol
LogP3.74
Rot. Bonds

About morpholin-4-yl(phenothiazin-10-yl)methanone

morpholin-4-yl(phenothiazin-10-yl)methanone (PubChem CID 705776) has the molecular formula C17H16N2O2S and a molecular weight of 312.39 g/mol. Its IUPAC name is morpholin-4-yl(phenothiazin-10-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl(phenothiazin-10-yl)methanone
PubChem CID705776
Molecular FormulaC17H16N2O2S
Molecular Weight312.39 g/mol
Exact Mass312.09
IUPAC Namemorpholin-4-yl(phenothiazin-10-yl)methanone
SMILESO=C(N1CCOCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C17H16N2O2S/c20-17(18-9-11-21-12-10-18)19-13-5-1-3-7-15(13)22-16-8-4-2-6-14(16)19/h1-8H,9-12H2
InChIKeyPWLGMYUBQYNSQV-UHFFFAOYSA-N
XLogP3.74
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-ylphenothiazine-10-carboxamide
CID 704259
Dimethoxanate
CID 10610
N,N-diethyl-10H-phenothiazine-10-carboxamide
CID 705771
Dimethoxanate Hydrochloride
CID 10609
N,N-dipropyl-10H-phenothiazine-10-carboxamide
CID 2235291
N,N-dimethyl-10H-phenothiazine-10-carboxamide
CID 2301676
2-(morpholin-4-yl)-1-(10H-phenothiazin-10-yl)ethanone
CID 713627
N,N-Diisopropyl-1''H-phenothiazine-1''-carboxamide
CID 12851057
N-cyclohexyl-10H-phenothiazine-10-carboxamide
CID 705769
10H-phenothiazin-10-yl(piperidin-1-yl)methanone
CID 705775
N-propyl-10H-phenothiazine-10-carboxamide
CID 1991974
N-butan-2-ylphenothiazine-10-carboxamide
CID 5150646

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(phenothiazin-10-yl)methanone?
The IUPAC name of morpholin-4-yl(phenothiazin-10-yl)methanone (CID 705776) is morpholin-4-yl(phenothiazin-10-yl)methanone.
What is the SMILES notation for morpholin-4-yl(phenothiazin-10-yl)methanone?
The canonical SMILES for morpholin-4-yl(phenothiazin-10-yl)methanone is O=C(N1CCOCC1)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of morpholin-4-yl(phenothiazin-10-yl)methanone?
The InChIKey is PWLGMYUBQYNSQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2S/c20-17(18-9-11-21-12-10-18)19-13-5-1-3-7-15(13)22-16-8-4-2-6-14(16)19/h1-8H,9-12H2.
What are the key properties of morpholin-4-yl(phenothiazin-10-yl)methanone?
morpholin-4-yl(phenothiazin-10-yl)methanone has a molecular weight of 312.39 g/mol, XLogP of 3.74, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(phenothiazin-10-yl)methanone is sourced from PubChem (CID 705776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).