5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one

C12H11NO4 — CID 139391203

IUPAC5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one
SMILESCOc1cc2[nH]ccc(=O)c2c2c1OCCO2
InChIInChI=1S/C12H11NO4/c1-15-9-6-7-10(8(14)2-3-13-7)12-11(9)16-4-5-17-12/h2-3,6H,4-5H2,1H3,(H,13,14)
InChIKeyDEOWBVFYXARZOO-UHFFFAOYSA-N
MW233.22 g/mol
LogP1.31
Rot. Bonds1

About 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one

5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one (PubChem CID 139391203) has the molecular formula C12H11NO4 and a molecular weight of 233.22 g/mol. Its IUPAC name is 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one.

Molecular Properties

Compound Name5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one
PubChem CID139391203
Molecular FormulaC12H11NO4
Molecular Weight233.22 g/mol
Exact Mass233.07
IUPAC Name5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one
SMILESCOc1cc2[nH]ccc(=O)c2c2c1OCCO2
InChIInChI=1S/C12H11NO4/c1-15-9-6-7-10(8(14)2-3-13-7)12-11(9)16-4-5-17-12/h2-3,6H,4-5H2,1H3,(H,13,14)
InChIKeyDEOWBVFYXARZOO-UHFFFAOYSA-N
XLogP1.31
TPSA60.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.22
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one with MolForge

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Related Compounds

6-methoxy-1-methyl-1,3,4,8-tetrahydropyrrolo[3,2-g][1,4]benzoxazepine-2-carboxylic acid
CID 67242605
5-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)isoindole-1,3-dione
CID 12043736
6-methoxy-7-propoxy-1H-quinolin-4-one;morpholine
CID 175262612
5,6,7-trifluoro-1H-quinolin-4-one
CID 62813764
6-ethyl-5,8-dimethoxy-2,3-dihydro-1,4-benzodioxine
CID 130420635
5-(3-methoxyphenoxy)-1H-quinolin-4-one
CID 91548000
methyl 1-[(6-methoxy-4-oxo-1H-quinolin-7-yl)oxymethyl]cyclopropane-1-carboxylate
CID 67265186
methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate
CID 168842836
3-(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)pentane-2,4-dione
CID 167564681
N-(5-methoxy-7,8-dihydro-1H-pyrano[2,3-g]indol-9-ylidene)hydroxylamine
CID 3067322
cyclohexane;methanethiol;7-methoxy-1H-quinolin-4-one
CID 157041036
5-methyl-7-(trifluoromethyl)-1H-quinolin-4-one
CID 169178050

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one?
The IUPAC name of 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one (CID 139391203) is 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one.
What is the SMILES notation for 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one?
The canonical SMILES for 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one is COc1cc2[nH]ccc(=O)c2c2c1OCCO2.
What is the InChIKey of 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one?
The InChIKey is DEOWBVFYXARZOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO4/c1-15-9-6-7-10(8(14)2-3-13-7)12-11(9)16-4-5-17-12/h2-3,6H,4-5H2,1H3,(H,13,14).
What are the key properties of 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one?
5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one has a molecular weight of 233.22 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one is sourced from PubChem (CID 139391203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).