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

C18H15Cl2N3O2 — CID 19592665

IUPAC2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide
SMILESCON(C)c1ccnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12
InChIInChI=1S/C18H15Cl2N3O2/c1-23(25-2)15-9-10-21-17-11(15)5-3-8-14(17)22-18(24)16-12(19)6-4-7-13(16)20/h3-10H,1-2H3,(H,22,24)
InChIKeyUIBYIFDCMJXQSW-UHFFFAOYSA-N
MW376.24 g/mol
LogP4.79
Rot. Bonds4

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

2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide (PubChem CID 19592665) has the molecular formula C18H15Cl2N3O2 and a molecular weight of 376.24 g/mol. Its IUPAC name is 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide
PubChem CID19592665
Molecular FormulaC18H15Cl2N3O2
Molecular Weight376.24 g/mol
Exact Mass375.05
IUPAC Name2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide
SMILESCON(C)c1ccnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12
InChIInChI=1S/C18H15Cl2N3O2/c1-23(25-2)15-9-10-21-17-11(15)5-3-8-14(17)22-18(24)16-12(19)6-4-7-13(16)20/h3-10H,1-2H3,(H,22,24)
InChIKeyUIBYIFDCMJXQSW-UHFFFAOYSA-N
XLogP4.79
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.24
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,6-dichloro-N-[4-[2-methoxyethyl(methyl)amino]quinolin-8-yl]benzamide
CID 19592575
N-[4-(2-acetyl-2-methylhydrazinyl)quinolin-8-yl]-2,6-dichlorobenzamide
CID 19592886
2,6-dichloro-N-[4-[hydroxy-[(1-methylimidazole-2-carbonyl)amino]amino]quinolin-8-yl]benzamide
CID 57037121
2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide
CID 139782538
N-(5-bromoquinolin-8-yl)-2,6-dichlorobenzamide
CID 35286890
N-[4-(3-aminopropylamino)quinolin-8-yl]-2,6-dichlorobenzamide
CID 19592896
2,6-dichloro-N-(4-chloro-6-methylquinolin-8-yl)benzamide
CID 19592532
2,6-dichloro-N-[4-[(dimethylamino)methyl]-3-ethylquinolin-8-yl]benzamide
CID 19592923
2,6-dichloro-N-(4-chloro-5-methylquinolin-8-yl)benzamide
CID 19592406
2,6-dichloro-N-[2-(2-methoxyethyl)-3-oxo-1H-pyrrolo[3,4-c]quinolin-6-yl]benzamide
CID 19592849
N-(4-acetyl-3-ethylquinolin-8-yl)-2,6-dichlorobenzamide
CID 19592898
2,6-dichloro-N-(3-methyl-4-pyrimidin-2-ylsulfanylquinolin-8-yl)benzamide
CID 19592443

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide (CID 19592665) is 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide is CON(C)c1ccnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12.
What is the InChIKey of 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide?
The InChIKey is UIBYIFDCMJXQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O2/c1-23(25-2)15-9-10-21-17-11(15)5-3-8-14(17)22-18(24)16-12(19)6-4-7-13(16)20/h3-10H,1-2H3,(H,22,24).
What are the key properties of 2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide?
2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide has a molecular weight of 376.24 g/mol, XLogP of 4.79, 4 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-[methoxy(methyl)amino]quinolin-8-yl]benzamide is sourced from PubChem (CID 19592665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).