6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide

C19H20N2O4 — CID 118285362

IUPAC6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide
SMILESCCc1cc2c(cc1OC)CC(CC)n1cc(C(=O)N=O)c(=O)cc1-2
InChIInChI=1S/C19H20N2O4/c1-4-11-7-14-12(8-18(11)25-3)6-13(5-2)21-10-15(19(23)20-24)17(22)9-16(14)21/h7-10,13H,4-6H2,1-3H3
InChIKeyGMWYSEKGTVEOIJ-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.50
Rot. Bonds4

About 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide

6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide (PubChem CID 118285362) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide.

Molecular Properties

Compound Name6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide
PubChem CID118285362
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide
SMILESCCc1cc2c(cc1OC)CC(CC)n1cc(C(=O)N=O)c(=O)cc1-2
InChIInChI=1S/C19H20N2O4/c1-4-11-7-14-12(8-18(11)25-3)6-13(5-2)21-10-15(19(23)20-24)17(22)9-16(14)21/h7-10,13H,4-6H2,1-3H3
InChIKeyGMWYSEKGTVEOIJ-UHFFFAOYSA-N
XLogP3.50
TPSA77.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide?
The IUPAC name of 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide (CID 118285362) is 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide.
What is the SMILES notation for 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide?
The canonical SMILES for 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide is CCc1cc2c(cc1OC)CC(CC)n1cc(C(=O)N=O)c(=O)cc1-2.
What is the InChIKey of 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide?
The InChIKey is GMWYSEKGTVEOIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-4-11-7-14-12(8-18(11)25-3)6-13(5-2)21-10-15(19(23)20-24)17(22)9-16(14)21/h7-10,13H,4-6H2,1-3H3.
What are the key properties of 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide?
6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide has a molecular weight of 340.38 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,10-diethyl-9-methoxy-N,2-dioxo-6,7-dihydrobenzo[a]quinolizine-3-carboxamide is sourced from PubChem (CID 118285362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).