2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide

C20H19Cl2N3O2 — CID 19592575

IUPAC2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide
SMILESCOCCN(C)c1ccnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12
InChIInChI=1S/C20H19Cl2N3O2/c1-25(11-12-27-2)17-9-10-23-19-13(17)5-3-8-16(19)24-20(26)18-14(21)6-4-7-15(18)22/h3-10H,11-12H2,1-2H3,(H,24,26)
InChIKeyXUEYIGUKGWDIRV-UHFFFAOYSA-N
MW404.30 g/mol
LogP4.88
Rot. Bonds6

About 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide

2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide (PubChem CID 19592575) has the molecular formula C20H19Cl2N3O2 and a molecular weight of 404.30 g/mol. Its IUPAC name is 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide
PubChem CID19592575
Molecular FormulaC20H19Cl2N3O2
Molecular Weight404.30 g/mol
Exact Mass403.09
IUPAC Name2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide
SMILESCOCCN(C)c1ccnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12
InChIInChI=1S/C20H19Cl2N3O2/c1-25(11-12-27-2)17-9-10-23-19-13(17)5-3-8-16(19)24-20(26)18-14(21)6-4-7-15(18)22/h3-10H,11-12H2,1-2H3,(H,24,26)
InChIKeyXUEYIGUKGWDIRV-UHFFFAOYSA-N
XLogP4.88
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.30
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide
CID 19592665
2,6-dichloro-N-[4-[hydroxy-[(1-methylimidazole-2-carbonyl)amino]amino]quinolin-8-yl]benzamide
CID 57037121
N-[4-(2-acetyl-2-methylhydrazinyl)quinolin-8-yl]-2,6-dichlorobenzamide
CID 19592886
2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide
CID 139782538
2,6-dichloro-N-[4-(2-methoxyethoxy)-2-methylquinolin-8-yl]benzamide
CID 139782319
2,6-dichloro-N-[3-(methoxymethyl)-4-pyrazol-1-ylquinolin-8-yl]benzamide
CID 19592781
N-[4-(3-aminopropylamino)quinolin-8-yl]-2,6-dichlorobenzamide
CID 19592896
N-(4-acetyl-3-ethylquinolin-8-yl)-2,6-dichlorobenzamide
CID 19592898
2,6-dichloro-N-[4-[(dimethylamino)methyl]-3-ethylquinolin-8-yl]benzamide
CID 19592923
2,6-dichloro-N-[2-(2-methoxyethyl)-3-oxo-1H-pyrrolo[3,4-c]quinolin-6-yl]benzamide
CID 19592849
N-(5-bromoquinolin-8-yl)-2,6-dichlorobenzamide
CID 35286890
2,6-dichloro-N-(4-chloro-6-methylquinolin-8-yl)benzamide
CID 19592532

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide (CID 19592575) is 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide is COCCN(C)c1ccnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12.
What is the InChIKey of 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide?
The InChIKey is XUEYIGUKGWDIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19Cl2N3O2/c1-25(11-12-27-2)17-9-10-23-19-13(17)5-3-8-16(19)24-20(26)18-14(21)6-4-7-15(18)22/h3-10H,11-12H2,1-2H3,(H,24,26).
What are the key properties of 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide?
2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide has a molecular weight of 404.30 g/mol, XLogP of 4.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide is sourced from PubChem (CID 19592575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).