7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one

C16H20N4O2 — CID 70413852

IUPAC7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one
SMILESCCN(CC)C(C)Oc1ccc2nc3[nH]c(=O)[nH]c3cc2c1
InChIInChI=1S/C16H20N4O2/c1-4-20(5-2)10(3)22-12-6-7-13-11(8-12)9-14-15(17-13)19-16(21)18-14/h6-10H,4-5H2,1-3H3,(H2,17,18,19,21)
InChIKeySYZSAZMFZORVDY-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.47
Rot. Bonds5

About 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one

7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one (PubChem CID 70413852) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one.

Molecular Properties

Compound Name7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one
PubChem CID70413852
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one
SMILESCCN(CC)C(C)Oc1ccc2nc3[nH]c(=O)[nH]c3cc2c1
InChIInChI=1S/C16H20N4O2/c1-4-20(5-2)10(3)22-12-6-7-13-11(8-12)9-14-15(17-13)19-16(21)18-14/h6-10H,4-5H2,1-3H3,(H2,17,18,19,21)
InChIKeySYZSAZMFZORVDY-UHFFFAOYSA-N
XLogP2.47
TPSA74.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxy]acetate
CID 21289996
5-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxymethyl]-3-propan-2-yl-1,3-oxazolidin-2-one
CID 14281037
7-(4-oxo-4-piperidin-1-ylbutoxy)-1,3-dihydroimidazo[4,5-b]quinolin-2-one
CID 14281011
ethyl 2-[4-[4-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxy]butanoyl]piperazin-1-yl]acetate
CID 15005639
3-tert-butyl-5-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxymethyl]-1,3-oxazolidin-2-one
CID 14281039
7-(5-hydroxypentyl)-1,3-dihydroimidazo[4,5-b]quinolin-2-one
CID 15005601
7-[4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one
CID 15005637
ethanol;4-[(4-fluorophenyl)methyl]-N-[3-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxy]propyl]piperazine-1-carboxamide;dihydrochloride
CID 70093461
ethyl 4-[5-[4-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxy]butyl]tetrazol-1-yl]piperidine-1-carboxylate
CID 14981443
7-[4-(1-cyclohexyltetrazol-5-yl)butoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one
CID 14281027
4-(2-cyclohexylethyl)-N-[3-[(2-oxo-1,3-dihydroimidazo[4,5-b]quinolin-7-yl)oxy]propyl]piperazine-1-carboxamide;dihydrochloride
CID 70092553
2,5-bis[1-(diethylamino)ethoxy]fluoren-9-one
CID 19594884

Frequently Asked Questions

What is the IUPAC name of 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
The IUPAC name of 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one (CID 70413852) is 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one.
What is the SMILES notation for 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
The canonical SMILES for 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one is CCN(CC)C(C)Oc1ccc2nc3[nH]c(=O)[nH]c3cc2c1.
What is the InChIKey of 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
The InChIKey is SYZSAZMFZORVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-4-20(5-2)10(3)22-12-6-7-13-11(8-12)9-14-15(17-13)19-16(21)18-14/h6-10H,4-5H2,1-3H3,(H2,17,18,19,21).
What are the key properties of 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one?
7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one has a molecular weight of 300.36 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(diethylamino)ethoxy]-1,3-dihydroimidazo[4,5-b]quinolin-2-one is sourced from PubChem (CID 70413852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).