7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one

C19H15FN4O4 — CID 126504847

IUPAC7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESCCOc1ccnc2[nH]c(=O)n(-c3cc(F)c4ncc5c(c4c3)OCCO5)c12
InChIInChI=1S/C19H15FN4O4/c1-2-26-13-3-4-21-18-16(13)24(19(25)23-18)10-7-11-15(12(20)8-10)22-9-14-17(11)28-6-5-27-14/h3-4,7-9H,2,5-6H2,1H3,(H,21,23,25)
InChIKeyLIZMRWUUFHNUJV-UHFFFAOYSA-N
MW382.35 g/mol
LogP2.57
Rot. Bonds3

About 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one

7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 126504847) has the molecular formula C19H15FN4O4 and a molecular weight of 382.35 g/mol. Its IUPAC name is 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID126504847
Molecular FormulaC19H15FN4O4
Molecular Weight382.35 g/mol
Exact Mass382.11
IUPAC Name7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESCCOc1ccnc2[nH]c(=O)n(-c3cc(F)c4ncc5c(c4c3)OCCO5)c12
InChIInChI=1S/C19H15FN4O4/c1-2-26-13-3-4-21-18-16(13)24(19(25)23-18)10-7-11-15(12(20)8-10)22-9-14-17(11)28-6-5-27-14/h3-4,7-9H,2,5-6H2,1H3,(H,21,23,25)
InChIKeyLIZMRWUUFHNUJV-UHFFFAOYSA-N
XLogP2.57
TPSA91.26 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.35
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one with MolForge

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Related Compounds

7-ethoxy-1-(8-fluoro-4-methoxyquinolin-6-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 126504387
1-(1,2-dihydrofuro[2,3-c]quinolin-8-yl)-7-ethoxy-3H-imidazo[4,5-b]pyridin-2-one
CID 126505040
1-(3,4-dimethoxyquinolin-6-yl)-7-ethoxy-3H-imidazo[4,5-b]pyridin-2-one
CID 126504416
1-(4-ethoxyquinolin-6-yl)-7-methoxy-3H-imidazo[4,5-b]pyridin-2-one
CID 126504485
7-ethoxy-1-(4-pyrrolidin-1-ylquinolin-6-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 126504682
7-ethoxy-1-(4-methoxy-3-pyridin-4-ylquinolin-6-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 126504612
7-ethoxy-1-(4-piperazin-1-ylquinolin-6-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 126504543
1-(4-amino-2-methoxyquinolin-6-yl)-7-ethoxy-3H-imidazo[4,5-b]pyridin-2-one
CID 126504802
1-(3-benzyl-2,4-dihydro-1H-benzo[c][2,7]naphthyridin-9-yl)-7-ethoxy-3H-imidazo[4,5-b]pyridin-2-one
CID 126504506
7-ethoxy-1-(3-methylimidazo[4,5-b]pyridin-5-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 126504747
4-ethoxy-N-[3-fluoro-4-[(5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl)oxy]phenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
CID 156759319
N-[4-[[5-[3-(dimethylamino)propoxy]-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]-3-fluorophenyl]-4-ethoxy-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide;4-ethoxy-N-[4-[(5-ethoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl)oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
CID 163991200

Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one (CID 126504847) is 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one is CCOc1ccnc2[nH]c(=O)n(-c3cc(F)c4ncc5c(c4c3)OCCO5)c12.
What is the InChIKey of 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is LIZMRWUUFHNUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O4/c1-2-26-13-3-4-21-18-16(13)24(19(25)23-18)10-7-11-15(12(20)8-10)22-9-14-17(11)28-6-5-27-14/h3-4,7-9H,2,5-6H2,1H3,(H,21,23,25).
What are the key properties of 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one?
7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 382.35 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-1-(7-fluoro-2,3-dihydro-[1,4]dioxino[2,3-c]quinolin-9-yl)-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 126504847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).