3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide

C24H28N2O6 — CID 3752311

IUPAC3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide
SMILESCCCN(Cc1cc2cc(OC)ccc2[nH]c1=O)C(=O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C24H28N2O6/c1-6-9-26(24(28)16-12-20(30-3)22(32-5)21(13-16)31-4)14-17-10-15-11-18(29-2)7-8-19(15)25-23(17)27/h7-8,10-13H,6,9,14H2,1-5H3,(H,25,27)
InChIKeyYTNZTCIJNJANCW-UHFFFAOYSA-N
MW440.50 g/mol
LogP3.61
Rot. Bonds9

About 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide

3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide (PubChem CID 3752311) has the molecular formula C24H28N2O6 and a molecular weight of 440.50 g/mol. Its IUPAC name is 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide.

Molecular Properties

Compound Name3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide
PubChem CID3752311
Molecular FormulaC24H28N2O6
Molecular Weight440.50 g/mol
Exact Mass440.19
IUPAC Name3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide
SMILESCCCN(Cc1cc2cc(OC)ccc2[nH]c1=O)C(=O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C24H28N2O6/c1-6-9-26(24(28)16-12-20(30-3)22(32-5)21(13-16)31-4)14-17-10-15-11-18(29-2)7-8-19(15)25-23(17)27/h7-8,10-13H,6,9,14H2,1-5H3,(H,25,27)
InChIKeyYTNZTCIJNJANCW-UHFFFAOYSA-N
XLogP3.61
TPSA90.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.50
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide with MolForge

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Related Compounds

N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(furan-2-ylmethyl)-3,4,5-trimethoxybenzamide
CID 1459170
3,4,5-trimethoxy-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
CID 2030338
N-[(4-fluorophenyl)methyl]-4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1459110
N-(2-hydroxyethyl)-4-methoxy-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1453430
N-(3-hydroxypropyl)-4-methoxy-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 3193899
N-butyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
CID 665147
N-[(4-fluorophenyl)methyl]-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 1459113
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methoxyphenyl)butanamide
CID 3157383
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propylbenzamide
CID 4020279
2-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylbenzamide
CID 1427730
3-methyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide
CID 1391861
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylfuran-2-carboxamide
CID 1421969

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide?
The IUPAC name of 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide (CID 3752311) is 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide.
What is the SMILES notation for 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide?
The canonical SMILES for 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide is CCCN(Cc1cc2cc(OC)ccc2[nH]c1=O)C(=O)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide?
The InChIKey is YTNZTCIJNJANCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O6/c1-6-9-26(24(28)16-12-20(30-3)22(32-5)21(13-16)31-4)14-17-10-15-11-18(29-2)7-8-19(15)25-23(17)27/h7-8,10-13H,6,9,14H2,1-5H3,(H,25,27).
What are the key properties of 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide?
3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide has a molecular weight of 440.50 g/mol, XLogP of 3.61, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-propylbenzamide is sourced from PubChem (CID 3752311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).