2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide

C16H8Cl4N2O — CID 139782538

IUPAC2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide
SMILESO=C(Nc1cccc2c(Cl)c(Cl)cnc12)c1c(Cl)cccc1Cl
InChIInChI=1S/C16H8Cl4N2O/c17-9-4-2-5-10(18)13(9)16(23)22-12-6-1-3-8-14(20)11(19)7-21-15(8)12/h1-7H,(H,22,23)
InChIKeyUPIAUFMJXWOLQZ-UHFFFAOYSA-N
MW386.07 g/mol
LogP6.10
Rot. Bonds2

About 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide

2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide (PubChem CID 139782538) has the molecular formula C16H8Cl4N2O and a molecular weight of 386.07 g/mol. Its IUPAC name is 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide
PubChem CID139782538
Molecular FormulaC16H8Cl4N2O
Molecular Weight386.07 g/mol
Exact Mass383.94
IUPAC Name2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide
SMILESO=C(Nc1cccc2c(Cl)c(Cl)cnc12)c1c(Cl)cccc1Cl
InChIInChI=1S/C16H8Cl4N2O/c17-9-4-2-5-10(18)13(9)16(23)22-12-6-1-3-8-14(20)11(19)7-21-15(8)12/h1-7H,(H,22,23)
InChIKeyUPIAUFMJXWOLQZ-UHFFFAOYSA-N
XLogP6.10
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.07
LogP ≤ 56.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-amino-2-oxoethyl)-3-chloroquinolin-8-yl]-2,6-dichlorobenzamide
CID 19592480
N-(4-acetyl-3-ethylquinolin-8-yl)-2,6-dichlorobenzamide
CID 19592898
N-[3-bromo-4-(bromomethyl)quinolin-8-yl]-2,6-dichlorobenzamide
CID 19592628
2,6-dichloro-N-[4-[(dimethylamino)methyl]-3-ethylquinolin-8-yl]benzamide
CID 19592923
2,6-dichloro-N-(3-methyl-4-pyrimidin-2-ylsulfanylquinolin-8-yl)benzamide
CID 19592443
N-(5-bromoquinolin-8-yl)-2,6-dichlorobenzamide
CID 35286890
2,6-dichloro-N-[4-(3,4-dichlorophenoxy)-3-methylquinolin-8-yl]benzamide
CID 139782456
2,6-dichloro-N-[4-[methoxy(methyl)amino]quinolin-8-yl]benzamide
CID 19592665
N-[4-(2-acetyl-2-methylhydrazinyl)quinolin-8-yl]-2,6-dichlorobenzamide
CID 19592886
ethyl 8-[(2,6-dichlorobenzoyl)amino]-4-[(dimethylamino)methyl]quinoline-3-carboxylate
CID 19592589
2,6-dichloro-N-[3-methyl-4-[2-(propylamino)ethylamino]quinolin-8-yl]benzamide
CID 139782357
N-[4-[(E)-3-amino-3-oxoprop-1-enyl]-3-ethylquinolin-8-yl]-2,6-dichlorobenzamide
CID 19593036

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide?
The IUPAC name of 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide (CID 139782538) is 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide is O=C(Nc1cccc2c(Cl)c(Cl)cnc12)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide?
The InChIKey is UPIAUFMJXWOLQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8Cl4N2O/c17-9-4-2-5-10(18)13(9)16(23)22-12-6-1-3-8-14(20)11(19)7-21-15(8)12/h1-7H,(H,22,23).
What are the key properties of 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide?
2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide has a molecular weight of 386.07 g/mol, XLogP of 6.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(3,4-dichloroquinolin-8-yl)benzamide is sourced from PubChem (CID 139782538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).