morpholin-4-yl(phenazin-1-yl)methanone

C17H15N3O2 — CID 3743226

IUPACmorpholin-4-yl(phenazin-1-yl)methanone
SMILESO=C(c1cccc2nc3ccccc3nc12)N1CCOCC1
InChIInChI=1S/C17H15N3O2/c21-17(20-8-10-22-11-9-20)12-4-3-7-15-16(12)19-14-6-2-1-5-13(14)18-15/h1-7H,8-11H2
InChIKeyQZRMEVYMQXLDAI-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.26
Rot. Bonds1

About morpholin-4-yl(phenazin-1-yl)methanone

morpholin-4-yl(phenazin-1-yl)methanone (PubChem CID 3743226) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is morpholin-4-yl(phenazin-1-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl(phenazin-1-yl)methanone
PubChem CID3743226
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Namemorpholin-4-yl(phenazin-1-yl)methanone
SMILESO=C(c1cccc2nc3ccccc3nc12)N1CCOCC1
InChIInChI=1S/C17H15N3O2/c21-17(20-8-10-22-11-9-20)12-4-3-7-15-16(12)19-14-6-2-1-5-13(14)18-15/h1-7H,8-11H2
InChIKeyQZRMEVYMQXLDAI-UHFFFAOYSA-N
XLogP2.26
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(phenazin-1-yl)methanone?
The IUPAC name of morpholin-4-yl(phenazin-1-yl)methanone (CID 3743226) is morpholin-4-yl(phenazin-1-yl)methanone.
What is the SMILES notation for morpholin-4-yl(phenazin-1-yl)methanone?
The canonical SMILES for morpholin-4-yl(phenazin-1-yl)methanone is O=C(c1cccc2nc3ccccc3nc12)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(phenazin-1-yl)methanone?
The InChIKey is QZRMEVYMQXLDAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c21-17(20-8-10-22-11-9-20)12-4-3-7-15-16(12)19-14-6-2-1-5-13(14)18-15/h1-7H,8-11H2.
What are the key properties of morpholin-4-yl(phenazin-1-yl)methanone?
morpholin-4-yl(phenazin-1-yl)methanone has a molecular weight of 293.33 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(phenazin-1-yl)methanone is sourced from PubChem (CID 3743226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).