(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate

C20H22N2O4 — CID 16533571

IUPAC(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
SMILESCC(OC(=O)c1c2c(nc3ccccc13)CCC2)C(=O)N1CCOCC1
InChIInChI=1S/C20H22N2O4/c1-13(19(23)22-9-11-25-12-10-22)26-20(24)18-14-5-2-3-7-16(14)21-17-8-4-6-15(17)18/h2-3,5,7,13H,4,6,8-12H2,1H3
InChIKeyLUZHIFHOIUQZGM-UHFFFAOYSA-N
MW354.41 g/mol
LogP2.13
Rot. Bonds3

About (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate

(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate (PubChem CID 16533571) has the molecular formula C20H22N2O4 and a molecular weight of 354.41 g/mol. Its IUPAC name is (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate.

Molecular Properties

Compound Name(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
PubChem CID16533571
Molecular FormulaC20H22N2O4
Molecular Weight354.41 g/mol
Exact Mass354.16
IUPAC Name(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
SMILESCC(OC(=O)c1c2c(nc3ccccc13)CCC2)C(=O)N1CCOCC1
InChIInChI=1S/C20H22N2O4/c1-13(19(23)22-9-11-25-12-10-22)26-20(24)18-14-5-2-3-7-16(14)21-17-8-4-6-15(17)18/h2-3,5,7,13H,4,6,8-12H2,1H3
InChIKeyLUZHIFHOIUQZGM-UHFFFAOYSA-N
XLogP2.13
TPSA68.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate with MolForge

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Related Compounds

[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate
CID 7277067
[(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate
CID 40764253
[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate
CID 40764255
[1-oxo-1-(1-phenylethylamino)propan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 55316986
[(1R)-1-cyanoethyl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 7440202
[(2R)-1-(4-fluorophenyl)-1-oxopropan-2-yl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 7223517
[(2R)-1-anilino-1-oxopropan-2-yl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 2627743
[(2S)-1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 7839828
[(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 8750345
[(2S)-1-(4-chlorophenyl)-1-oxopropan-2-yl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 7298389
[1-(4-chlorophenyl)-1-oxopropan-2-yl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 5295168
[(2S)-1-oxo-1-[[(2S)-2-phenylpropyl]amino]propan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 9139205

Frequently Asked Questions

What is the IUPAC name of (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate?
The IUPAC name of (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate (CID 16533571) is (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate.
What is the SMILES notation for (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate?
The canonical SMILES for (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate is CC(OC(=O)c1c2c(nc3ccccc13)CCC2)C(=O)N1CCOCC1.
What is the InChIKey of (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate?
The InChIKey is LUZHIFHOIUQZGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4/c1-13(19(23)22-9-11-25-12-10-22)26-20(24)18-14-5-2-3-7-16(14)21-17-8-4-6-15(17)18/h2-3,5,7,13H,4,6,8-12H2,1H3.
What are the key properties of (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate?
(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate has a molecular weight of 354.41 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate is sourced from PubChem (CID 16533571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).