N-(6-chloroquinolin-8-yl)-2-fluorobenzamide

C16H10ClFN2O — CID 39975947

IUPACN-(6-chloroquinolin-8-yl)-2-fluorobenzamide
SMILESO=C(Nc1cc(Cl)cc2cccnc12)c1ccccc1F
InChIInChI=1S/C16H10ClFN2O/c17-11-8-10-4-3-7-19-15(10)14(9-11)20-16(21)12-5-1-2-6-13(12)18/h1-9H,(H,20,21)
InChIKeyCTARJSHLFSTTLN-UHFFFAOYSA-N
MW300.72 g/mol
LogP4.28
Rot. Bonds2

About N-(6-chloroquinolin-8-yl)-2-fluorobenzamide

N-(6-chloroquinolin-8-yl)-2-fluorobenzamide (PubChem CID 39975947) has the molecular formula C16H10ClFN2O and a molecular weight of 300.72 g/mol. Its IUPAC name is N-(6-chloroquinolin-8-yl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(6-chloroquinolin-8-yl)-2-fluorobenzamide
PubChem CID39975947
Molecular FormulaC16H10ClFN2O
Molecular Weight300.72 g/mol
Exact Mass300.05
IUPAC NameN-(6-chloroquinolin-8-yl)-2-fluorobenzamide
SMILESO=C(Nc1cc(Cl)cc2cccnc12)c1ccccc1F
InChIInChI=1S/C16H10ClFN2O/c17-11-8-10-4-3-7-19-15(10)14(9-11)20-16(21)12-5-1-2-6-13(12)18/h1-9H,(H,20,21)
InChIKeyCTARJSHLFSTTLN-UHFFFAOYSA-N
XLogP4.28
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.72
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(6-chloroquinolin-8-yl)-2-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 43052391
5-chloro-2-fluoro-N-quinolin-8-ylbenzamide
CID 17416993
3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide
CID 104741160
N-(6-chloroquinolin-8-yl)furan-2-carboxamide
CID 60729929
3-amino-N-(6-chloroquinolin-8-yl)benzamide
CID 43698580
N-(6-chloroquinolin-8-yl)-1,4-dimethylpyrazole-3-carboxamide
CID 166321071
2-chloro-N-(6-chloroquinolin-8-yl)propanamide
CID 43696479
3-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846762
5-bromo-2-fluoro-N-quinolin-8-ylbenzamide
CID 24710942
2-amino-N-(5-chloro-2-fluorophenyl)pyridine-3-carboxamide
CID 62154779
N-(6-chloroquinolin-8-yl)-2-(2,4-difluorophenyl)sulfanylacetamide
CID 24673455
6-chloro-N-[1-(2-fluorophenyl)ethyl]quinolin-8-amine
CID 43672450

Frequently Asked Questions

What is the IUPAC name of N-(6-chloroquinolin-8-yl)-2-fluorobenzamide?
The IUPAC name of N-(6-chloroquinolin-8-yl)-2-fluorobenzamide (CID 39975947) is N-(6-chloroquinolin-8-yl)-2-fluorobenzamide.
What is the SMILES notation for N-(6-chloroquinolin-8-yl)-2-fluorobenzamide?
The canonical SMILES for N-(6-chloroquinolin-8-yl)-2-fluorobenzamide is O=C(Nc1cc(Cl)cc2cccnc12)c1ccccc1F.
What is the InChIKey of N-(6-chloroquinolin-8-yl)-2-fluorobenzamide?
The InChIKey is CTARJSHLFSTTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClFN2O/c17-11-8-10-4-3-7-19-15(10)14(9-11)20-16(21)12-5-1-2-6-13(12)18/h1-9H,(H,20,21).
What are the key properties of N-(6-chloroquinolin-8-yl)-2-fluorobenzamide?
N-(6-chloroquinolin-8-yl)-2-fluorobenzamide has a molecular weight of 300.72 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloroquinolin-8-yl)-2-fluorobenzamide is sourced from PubChem (CID 39975947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).