7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one

C14H15NO3 — CID 43667939

IUPAC7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one
SMILESCCCc1cc(=O)c2cc3c(cc2[nH]1)OCCO3
InChIInChI=1S/C14H15NO3/c1-2-3-9-6-12(16)10-7-13-14(8-11(10)15-9)18-5-4-17-13/h6-8H,2-5H2,1H3,(H,15,16)
InChIKeyFNQINDXBWLHFGR-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.25
Rot. Bonds2

About 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one

7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one (PubChem CID 43667939) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one.

Molecular Properties

Compound Name7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one
PubChem CID43667939
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one
SMILESCCCc1cc(=O)c2cc3c(cc2[nH]1)OCCO3
InChIInChI=1S/C14H15NO3/c1-2-3-9-6-12(16)10-7-13-14(8-11(10)15-9)18-5-4-17-13/h6-8H,2-5H2,1H3,(H,15,16)
InChIKeyFNQINDXBWLHFGR-UHFFFAOYSA-N
XLogP2.25
TPSA51.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,6,7-tetrahydro-[1,4]dioxino[2,3-f]indazol-3-one
CID 114589168
8-(2-aminoethyl)-9-methyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
CID 84638095
7,8-dimethyl-3,6-dihydro-2H-[1,4]dioxino[2,3-f]indole
CID 82491733
3-ethyl-1,7,8,9-tetrahydro-[1,4]dioxepino[2,3-g]quinazoline-2,4-dione
CID 115587404
6-bromo-2-butyl-1H-quinolin-4-one
CID 155408645
2,6-dipropyl-1H-pyridin-4-one
CID 137405391
1-(7-methyl-3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)propan-2-one
CID 82497834
2-heptyl-1H-quinolin-4-one
CID 172676764
6,8-dibromo-2-propyl-1H-quinolin-4-one
CID 61477841
2-heptyl-1H-quinolin-4-one
CID 172676765
ethyl 8-chloro-3,6-dihydro-2H-[1,4]dioxino[2,3-f]indole-7-carboxylate
CID 12823093
8-fluoro-2-propyl-1H-quinolin-4-one
CID 39346190

Frequently Asked Questions

What is the IUPAC name of 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one?
The IUPAC name of 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one (CID 43667939) is 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one.
What is the SMILES notation for 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one?
The canonical SMILES for 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one is CCCc1cc(=O)c2cc3c(cc2[nH]1)OCCO3.
What is the InChIKey of 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one?
The InChIKey is FNQINDXBWLHFGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-2-3-9-6-12(16)10-7-13-14(8-11(10)15-9)18-5-4-17-13/h6-8H,2-5H2,1H3,(H,15,16).
What are the key properties of 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one?
7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one has a molecular weight of 245.28 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propyl-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-9-one is sourced from PubChem (CID 43667939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).