2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide

C16H9Cl3N2O — CID 122229021

IUPAC2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide
SMILESO=C(Nc1c(Cl)cc(Cl)c2cccnc12)c1ccccc1Cl
InChIInChI=1S/C16H9Cl3N2O/c17-11-6-2-1-4-10(11)16(22)21-15-13(19)8-12(18)9-5-3-7-20-14(9)15/h1-8H,(H,21,22)
InChIKeyGOEWMQDLPAYIFT-UHFFFAOYSA-N
MW351.62 g/mol
LogP5.45
Rot. Bonds2

About 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide

2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide (PubChem CID 122229021) has the molecular formula C16H9Cl3N2O and a molecular weight of 351.62 g/mol. Its IUPAC name is 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide
PubChem CID122229021
Molecular FormulaC16H9Cl3N2O
Molecular Weight351.62 g/mol
Exact Mass349.98
IUPAC Name2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide
SMILESO=C(Nc1c(Cl)cc(Cl)c2cccnc12)c1ccccc1Cl
InChIInChI=1S/C16H9Cl3N2O/c17-11-6-2-1-4-10(11)16(22)21-15-13(19)8-12(18)9-5-3-7-20-14(9)15/h1-8H,(H,21,22)
InChIKeyGOEWMQDLPAYIFT-UHFFFAOYSA-N
XLogP5.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.62
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide
CID 110472978
2-chloro-N-(2-chloro-3-pyridinyl)benzamide
CID 4245221
3-chloro-N-(5-chloroquinolin-8-yl)pyridine-4-carboxamide
CID 66464804
(5,7-dichloroquinolin-8-yl) 2-bromobenzoate
CID 4196759
5-chloro-8-hydroxyquinoline-7-carboxylic acid
CID 14534767
N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide
CID 110864324
5,7-dichloroquinolin-8-ol;nickel
CID 175096460
N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide
CID 63047841
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
CID 103892911
2-chloro-N-(4-hydroxy-2,6-dimethylphenyl)benzamide
CID 706333
5-chloro-N-[3-(hydroxymethyl)phenyl]quinoline-8-carboxamide
CID 110910882
N-(6-chloroquinolin-8-yl)-2-fluorobenzamide
CID 39975947

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide?
The IUPAC name of 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide (CID 122229021) is 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide.
What is the SMILES notation for 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide?
The canonical SMILES for 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide is O=C(Nc1c(Cl)cc(Cl)c2cccnc12)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide?
The InChIKey is GOEWMQDLPAYIFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9Cl3N2O/c17-11-6-2-1-4-10(11)16(22)21-15-13(19)8-12(18)9-5-3-7-20-14(9)15/h1-8H,(H,21,22).
What are the key properties of 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide?
2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide has a molecular weight of 351.62 g/mol, XLogP of 5.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5,7-dichloroquinolin-8-yl)benzamide is sourced from PubChem (CID 122229021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).