4-(morpholine-4-carbonyl)phenoxazin-3-one

C17H14N2O4 — CID 56620410

IUPAC4-(morpholine-4-carbonyl)phenoxazin-3-one
SMILESO=C(c1c2oc3ccccc3nc-2ccc1=O)N1CCOCC1
InChIInChI=1S/C17H14N2O4/c20-13-6-5-12-16(23-14-4-2-1-3-11(14)18-12)15(13)17(21)19-7-9-22-10-8-19/h1-6H,7-10H2
InChIKeyJCFHRFWXNUJUHR-UHFFFAOYSA-N
MW310.31 g/mol
LogP1.77
Rot. Bonds1

About 4-(morpholine-4-carbonyl)phenoxazin-3-one

4-(morpholine-4-carbonyl)phenoxazin-3-one (PubChem CID 56620410) has the molecular formula C17H14N2O4 and a molecular weight of 310.31 g/mol. Its IUPAC name is 4-(morpholine-4-carbonyl)phenoxazin-3-one.

Molecular Properties

Compound Name4-(morpholine-4-carbonyl)phenoxazin-3-one
PubChem CID56620410
Molecular FormulaC17H14N2O4
Molecular Weight310.31 g/mol
Exact Mass310.10
IUPAC Name4-(morpholine-4-carbonyl)phenoxazin-3-one
SMILESO=C(c1c2oc3ccccc3nc-2ccc1=O)N1CCOCC1
InChIInChI=1S/C17H14N2O4/c20-13-6-5-12-16(23-14-4-2-1-3-11(14)18-12)15(13)17(21)19-7-9-22-10-8-19/h1-6H,7-10H2
InChIKeyJCFHRFWXNUJUHR-UHFFFAOYSA-N
XLogP1.77
TPSA72.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.31
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2,5-dioxopyrrolidin-1-yl) [1-(3-oxophenoxazine-4-carbonyl)piperidin-4-yl] carbonate
CID 87366390
[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-morpholin-4-ylmethanone
CID 24632142
[2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-morpholin-4-ylmethanone
CID 36708523
[4-[1-(1,3-benzoxazol-2-yl)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 75498808
2-methyl-3-(morpholine-4-carbonyl)benzo[f][1]benzofuran-4,9-dione
CID 1382504
(2-methylquinolin-3-yl)-morpholin-4-ylmethanone
CID 110489563
[1-(1,3-benzoxazol-2-ylmethyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 56810173
(3-methyl-2-phenylquinolin-4-yl)-morpholin-4-ylmethanone
CID 868745
morpholin-4-yl(phenazin-1-yl)methanone
CID 3743226
morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone
CID 58440618
(2,6-difluorophenyl)-morpholin-4-ylmethanone
CID 532216
(2R)-2-[(3S)-3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 95592437

Frequently Asked Questions

What is the IUPAC name of 4-(morpholine-4-carbonyl)phenoxazin-3-one?
The IUPAC name of 4-(morpholine-4-carbonyl)phenoxazin-3-one (CID 56620410) is 4-(morpholine-4-carbonyl)phenoxazin-3-one.
What is the SMILES notation for 4-(morpholine-4-carbonyl)phenoxazin-3-one?
The canonical SMILES for 4-(morpholine-4-carbonyl)phenoxazin-3-one is O=C(c1c2oc3ccccc3nc-2ccc1=O)N1CCOCC1.
What is the InChIKey of 4-(morpholine-4-carbonyl)phenoxazin-3-one?
The InChIKey is JCFHRFWXNUJUHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O4/c20-13-6-5-12-16(23-14-4-2-1-3-11(14)18-12)15(13)17(21)19-7-9-22-10-8-19/h1-6H,7-10H2.
What are the key properties of 4-(morpholine-4-carbonyl)phenoxazin-3-one?
4-(morpholine-4-carbonyl)phenoxazin-3-one has a molecular weight of 310.31 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(morpholine-4-carbonyl)phenoxazin-3-one is sourced from PubChem (CID 56620410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).