10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one

C24H24N2O3S — CID 14666690

IUPAC10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one
SMILESCC1CN(C(=O)c2cc(-c3ccccc3)c(=O)n3c2-c2sccc2CC3)CC(C)O1
InChIInChI=1S/C24H24N2O3S/c1-15-13-25(14-16(2)29-15)23(27)20-12-19(17-6-4-3-5-7-17)24(28)26-10-8-18-9-11-30-22(18)21(20)26/h3-7,9,11-12,15-16H,8,10,13-14H2,1-2H3
InChIKeyDTBVNJRKIUNNMR-UHFFFAOYSA-N
MW420.53 g/mol
LogP4.05
Rot. Bonds2

About 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one

10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one (PubChem CID 14666690) has the molecular formula C24H24N2O3S and a molecular weight of 420.53 g/mol. Its IUPAC name is 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one.

Molecular Properties

Compound Name10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one
PubChem CID14666690
Molecular FormulaC24H24N2O3S
Molecular Weight420.53 g/mol
Exact Mass420.15
IUPAC Name10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one
SMILESCC1CN(C(=O)c2cc(-c3ccccc3)c(=O)n3c2-c2sccc2CC3)CC(C)O1
InChIInChI=1S/C24H24N2O3S/c1-15-13-25(14-16(2)29-15)23(27)20-12-19(17-6-4-3-5-7-17)24(28)26-10-8-18-9-11-30-22(18)21(20)26/h3-7,9,11-12,15-16H,8,10,13-14H2,1-2H3
InChIKeyDTBVNJRKIUNNMR-UHFFFAOYSA-N
XLogP4.05
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.53
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one?
The IUPAC name of 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one (CID 14666690) is 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one.
What is the SMILES notation for 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one?
The canonical SMILES for 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one is CC1CN(C(=O)c2cc(-c3ccccc3)c(=O)n3c2-c2sccc2CC3)CC(C)O1.
What is the InChIKey of 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one?
The InChIKey is DTBVNJRKIUNNMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3S/c1-15-13-25(14-16(2)29-15)23(27)20-12-19(17-6-4-3-5-7-17)24(28)26-10-8-18-9-11-30-22(18)21(20)26/h3-7,9,11-12,15-16H,8,10,13-14H2,1-2H3.
What are the key properties of 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one?
10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one has a molecular weight of 420.53 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2,6-dimethylmorpholine-4-carbonyl)-8-phenyl-4,5-dihydrothieno[2,3-a]quinolizin-7-one is sourced from PubChem (CID 14666690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).