3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one

C16H18N4O2 — CID 141045027

IUPAC3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one
SMILESO=c1cc[nH]c2cc3c(cc12)ncn3CCN1CCOCC1
InChIInChI=1S/C16H18N4O2/c21-16-1-2-17-13-10-15-14(9-12(13)16)18-11-20(15)4-3-19-5-7-22-8-6-19/h1-2,9-11H,3-8H2,(H,17,21)
InChIKeyJUTHNBIUNKGYNL-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.21
Rot. Bonds3

About 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one

3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one (PubChem CID 141045027) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one.

Molecular Properties

Compound Name3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one
PubChem CID141045027
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one
SMILESO=c1cc[nH]c2cc3c(cc12)ncn3CCN1CCOCC1
InChIInChI=1S/C16H18N4O2/c21-16-1-2-17-13-10-15-14(9-12(13)16)18-11-20(15)4-3-19-5-7-22-8-6-19/h1-2,9-11H,3-8H2,(H,17,21)
InChIKeyJUTHNBIUNKGYNL-UHFFFAOYSA-N
XLogP1.21
TPSA63.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one?
The IUPAC name of 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one (CID 141045027) is 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one.
What is the SMILES notation for 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one?
The canonical SMILES for 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one is O=c1cc[nH]c2cc3c(cc12)ncn3CCN1CCOCC1.
What is the InChIKey of 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one?
The InChIKey is JUTHNBIUNKGYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c21-16-1-2-17-13-10-15-14(9-12(13)16)18-11-20(15)4-3-19-5-7-22-8-6-19/h1-2,9-11H,3-8H2,(H,17,21).
What are the key properties of 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one?
3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one has a molecular weight of 298.35 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-ylethyl)-5H-imidazo[4,5-g]quinolin-8-one is sourced from PubChem (CID 141045027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).