6-chloropyrazino[2,3-a]phenoxazin-5-one

C14H6ClN3O2 — CID 141389600

IUPAC6-chloropyrazino[2,3-a]phenoxazin-5-one
SMILESO=c1c(Cl)c2oc3ccccc3nc-2c2nccnc12
InChIInChI=1S/C14H6ClN3O2/c15-9-13(19)11-10(16-5-6-17-11)12-14(9)20-8-4-2-1-3-7(8)18-12/h1-6H
InChIKeyPGABJXYKGSCDON-UHFFFAOYSA-N
MW283.67 g/mol
LogP2.89
Rot. Bonds

About 6-chloropyrazino[2,3-a]phenoxazin-5-one

6-chloropyrazino[2,3-a]phenoxazin-5-one (PubChem CID 141389600) has the molecular formula C14H6ClN3O2 and a molecular weight of 283.67 g/mol. Its IUPAC name is 6-chloropyrazino[2,3-a]phenoxazin-5-one.

Molecular Properties

Compound Name6-chloropyrazino[2,3-a]phenoxazin-5-one
PubChem CID141389600
Molecular FormulaC14H6ClN3O2
Molecular Weight283.67 g/mol
Exact Mass283.01
IUPAC Name6-chloropyrazino[2,3-a]phenoxazin-5-one
SMILESO=c1c(Cl)c2oc3ccccc3nc-2c2nccnc12
InChIInChI=1S/C14H6ClN3O2/c15-9-13(19)11-10(16-5-6-17-11)12-14(9)20-8-4-2-1-3-7(8)18-12/h1-6H
InChIKeyPGABJXYKGSCDON-UHFFFAOYSA-N
XLogP2.89
TPSA68.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.67
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

6-chloropyrido[3,2-a]phenoxazin-5-one
CID 141389603
1,2,4-trichlorophenoxazin-3-one
CID 56606166
CID 23443898
CID 23443898
6-bromobenzo[a]phenoxazin-5-one
CID 12933237
chromen-2-one;quinoxaline
CID 174951370
3-(1,3-benzoxazol-2-yl)pyrazin-2-amine
CID 67388669
benzo[d][1,3,7]benzodioxazonin-6-one
CID 42644773
3-(furan-2-yl)-1,4-benzoxazin-2-one
CID 164680158
3-(4-bromophenyl)-1,4-benzoxazin-2-one
CID 72696232
9-[bis(2-methoxyethyl)amino]-6-chlorobenzo[a]phenoxazin-5-one
CID 18730942
2-(3,4,5-trichlorophenyl)-1,3-benzoxazole
CID 50849649
1,4-benzoxazin-2-one;hydrochloride
CID 154928875

Frequently Asked Questions

What is the IUPAC name of 6-chloropyrazino[2,3-a]phenoxazin-5-one?
The IUPAC name of 6-chloropyrazino[2,3-a]phenoxazin-5-one (CID 141389600) is 6-chloropyrazino[2,3-a]phenoxazin-5-one.
What is the SMILES notation for 6-chloropyrazino[2,3-a]phenoxazin-5-one?
The canonical SMILES for 6-chloropyrazino[2,3-a]phenoxazin-5-one is O=c1c(Cl)c2oc3ccccc3nc-2c2nccnc12.
What is the InChIKey of 6-chloropyrazino[2,3-a]phenoxazin-5-one?
The InChIKey is PGABJXYKGSCDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H6ClN3O2/c15-9-13(19)11-10(16-5-6-17-11)12-14(9)20-8-4-2-1-3-7(8)18-12/h1-6H.
What are the key properties of 6-chloropyrazino[2,3-a]phenoxazin-5-one?
6-chloropyrazino[2,3-a]phenoxazin-5-one has a molecular weight of 283.67 g/mol, XLogP of 2.89, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloropyrazino[2,3-a]phenoxazin-5-one is sourced from PubChem (CID 141389600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).