ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one

C15H17FN2O2 — CID 145278996

IUPACethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one
SMILESCC.Cc1cc2c3c(cnc2cc1F)N(C)C(=O)CO3
InChIInChI=1S/C13H11FN2O2.C2H6/c1-7-3-8-10(4-9(7)14)15-5-11-13(8)18-6-12(17)16(11)2;1-2/h3-5H,6H2,1-2H3;1-2H3
InChIKeyVRAFXBILXFMLCA-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.06
Rot. Bonds

About ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one

ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one (PubChem CID 145278996) has the molecular formula C15H17FN2O2 and a molecular weight of 276.31 g/mol. Its IUPAC name is ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one.

Molecular Properties

Compound Nameethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one
PubChem CID145278996
Molecular FormulaC15H17FN2O2
Molecular Weight276.31 g/mol
Exact Mass276.13
IUPAC Nameethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one
SMILESCC.Cc1cc2c3c(cnc2cc1F)N(C)C(=O)CO3
InChIInChI=1S/C13H11FN2O2.C2H6/c1-7-3-8-10(4-9(7)14)15-5-11-13(8)18-6-12(17)16(11)2;1-2/h3-5H,6H2,1-2H3;1-2H3
InChIKeyVRAFXBILXFMLCA-UHFFFAOYSA-N
XLogP3.06
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-fluoro-4-methyl-1,4-benzoxazin-3-one
CID 66697398
4-bromo-3-chloro-7-fluoro-6-methylquinoline
CID 114764153
7-fluoro-4,6-dimethylquinazoline
CID 67990851
7-acetyl-1-methylpyrido[2,3-b][1,4]oxazin-2-one
CID 90292532
6-bromo-4,7,8-trimethyl-1,4-benzoxazin-3-one
CID 82233498
7-[[3-(cyclopropylmethyl)-6-fluorobenzimidazol-5-yl]amino]-4-methylpyrido[4,3-b][1,4]oxazin-3-one
CID 118278468
ethane;5-fluoro-2,6-dimethylisoindole-1,3-dione
CID 169161651
8'-bromo-7'-fluoro-3-hydroxy-3'-methylspiro[cyclobutane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one
CID 146211646
8-amino-6-chloro-4-methyl-1,4-benzoxazin-3-one
CID 75355772
8-(2-aminoethyl)-6-bromo-4-methyl-1,4-benzoxazin-3-one
CID 82275405
6-iodo-4-methyl-1,4-benzoxazin-3-one
CID 15171871
ethane;4-methyl-1,4-benzoxazin-3-one
CID 91027337

Frequently Asked Questions

What is the IUPAC name of ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one?
The IUPAC name of ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one (CID 145278996) is ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one.
What is the SMILES notation for ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one?
The canonical SMILES for ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one is CC.Cc1cc2c3c(cnc2cc1F)N(C)C(=O)CO3.
What is the InChIKey of ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one?
The InChIKey is VRAFXBILXFMLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2.C2H6/c1-7-3-8-10(4-9(7)14)15-5-11-13(8)18-6-12(17)16(11)2;1-2/h3-5H,6H2,1-2H3;1-2H3.
What are the key properties of ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one?
ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one has a molecular weight of 276.31 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;8-fluoro-4,9-dimethyl-[1,4]oxazino[3,2-c]quinolin-3-one is sourced from PubChem (CID 145278996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).