6,7-difluoro-1-methoxy-10-methylacridin-9-one

C15H11F2NO2 — CID 102061435

IUPAC6,7-difluoro-1-methoxy-10-methylacridin-9-one
SMILESCOc1cccc2c1c(=O)c1cc(F)c(F)cc1n2C
InChIInChI=1S/C15H11F2NO2/c1-18-11-4-3-5-13(20-2)14(11)15(19)8-6-9(16)10(17)7-12(8)18/h3-7H,1-2H3
InChIKeyWSJGGDZXLZQDLC-UHFFFAOYSA-N
MW275.25 g/mol
LogP2.98
Rot. Bonds1

About 6,7-difluoro-1-methoxy-10-methylacridin-9-one

6,7-difluoro-1-methoxy-10-methylacridin-9-one (PubChem CID 102061435) has the molecular formula C15H11F2NO2 and a molecular weight of 275.25 g/mol. Its IUPAC name is 6,7-difluoro-1-methoxy-10-methylacridin-9-one.

Molecular Properties

Compound Name6,7-difluoro-1-methoxy-10-methylacridin-9-one
PubChem CID102061435
Molecular FormulaC15H11F2NO2
Molecular Weight275.25 g/mol
Exact Mass275.08
IUPAC Name6,7-difluoro-1-methoxy-10-methylacridin-9-one
SMILESCOc1cccc2c1c(=O)c1cc(F)c(F)cc1n2C
InChIInChI=1S/C15H11F2NO2/c1-18-11-4-3-5-13(20-2)14(11)15(19)8-6-9(16)10(17)7-12(8)18/h3-7H,1-2H3
InChIKeyWSJGGDZXLZQDLC-UHFFFAOYSA-N
XLogP2.98
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.25
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-methoxy-2,9-dimethylcarbazole
CID 86239473
5-methoxy-9-methyl-2-(trifluoromethyl)carbazole
CID 139447926
2-butyl-5-methoxy-9-methylcarbazole
CID 86239479
5-methoxy-9-methyl-2H-pyrido[3,4-b]indol-1-one
CID 115036593
6-chloro-1,4-dimethoxy-10-methylacridin-9-one
CID 102061426
3-chloro-5-methoxy-9-methylpyrido[3,4-b]indole
CID 115045950
4,11-bis(2-methoxyphenyl)-5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
CID 138654549
1-hydroxy-2,3-dimethoxy-10-methylacridin-9-one
CID 5281832
3-(aminomethyl)-5-methoxy-1-methylquinazoline-2,4-dione
CID 117262276
1-hydroxy-2-iodo-3-methoxy-10-methylacridin-9-one
CID 14846764
N-(2,5-difluorophenyl)-4-hydroxy-5-methoxy-N,1-dimethyl-2-oxoquinoline-3-carboxamide
CID 54682588
5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
CID 2844779

Frequently Asked Questions

What is the IUPAC name of 6,7-difluoro-1-methoxy-10-methylacridin-9-one?
The IUPAC name of 6,7-difluoro-1-methoxy-10-methylacridin-9-one (CID 102061435) is 6,7-difluoro-1-methoxy-10-methylacridin-9-one.
What is the SMILES notation for 6,7-difluoro-1-methoxy-10-methylacridin-9-one?
The canonical SMILES for 6,7-difluoro-1-methoxy-10-methylacridin-9-one is COc1cccc2c1c(=O)c1cc(F)c(F)cc1n2C.
What is the InChIKey of 6,7-difluoro-1-methoxy-10-methylacridin-9-one?
The InChIKey is WSJGGDZXLZQDLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2NO2/c1-18-11-4-3-5-13(20-2)14(11)15(19)8-6-9(16)10(17)7-12(8)18/h3-7H,1-2H3.
What are the key properties of 6,7-difluoro-1-methoxy-10-methylacridin-9-one?
6,7-difluoro-1-methoxy-10-methylacridin-9-one has a molecular weight of 275.25 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-difluoro-1-methoxy-10-methylacridin-9-one is sourced from PubChem (CID 102061435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).