N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide

C16H10ClFN2O — CID 142343829

IUPACN-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc2ncccc2cc1F
InChIInChI=1S/C16H10ClFN2O/c17-11-3-5-12(6-4-11)20-16(21)13-9-15-10(8-14(13)18)2-1-7-19-15/h1-9H,(H,20,21)
InChIKeyXENJGSOEGDXFAA-UHFFFAOYSA-N
MW300.72 g/mol
LogP4.28
Rot. Bonds2

About N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide

N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide (PubChem CID 142343829) has the molecular formula C16H10ClFN2O and a molecular weight of 300.72 g/mol. Its IUPAC name is N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide
PubChem CID142343829
Molecular FormulaC16H10ClFN2O
Molecular Weight300.72 g/mol
Exact Mass300.05
IUPAC NameN-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc2ncccc2cc1F
InChIInChI=1S/C16H10ClFN2O/c17-11-3-5-12(6-4-11)20-16(21)13-9-15-10(8-14(13)18)2-1-7-19-15/h1-9H,(H,20,21)
InChIKeyXENJGSOEGDXFAA-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

6-fluoro-N-[6-(trifluoromethoxy)-3-pyridinyl]quinoline-7-carboxamide
CID 142343785
6-fluoroquinoline-7-carboxylic acid
CID 175475921
4-chloro-2-hydroxy-N-quinolin-6-ylbenzamide
CID 60783622
N-(3-chlorophenyl)-6-methylquinoline-7-carboxamide
CID 142343847
N-(4-chlorophenyl)-2-(quinolin-6-ylmethylsulfanyl)pyridine-3-carboxamide
CID 11847040
5-chloro-2-fluoro-N-(4-pyrimidin-2-yloxyphenyl)benzamide
CID 47051311
3-chloro-N-quinolin-6-ylpyridine-4-carboxamide
CID 66484536
N-(4-chlorophenyl)pyrimidine-2-carboxamide
CID 56724074
N-(4-chlorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 62167597
7-fluoroquinoline-6-carboxylic acid
CID 77174821
4-chloro-2-fluoro-N-(4-pyrimidin-2-yloxyphenyl)benzamide
CID 47051312
N-(3-bromo-4-fluorophenyl)quinoline-6-carboxamide
CID 115661425

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide (CID 142343829) is N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide is O=C(Nc1ccc(Cl)cc1)c1cc2ncccc2cc1F.
What is the InChIKey of N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide?
The InChIKey is XENJGSOEGDXFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClFN2O/c17-11-3-5-12(6-4-11)20-16(21)13-9-15-10(8-14(13)18)2-1-7-19-15/h1-9H,(H,20,21).
What are the key properties of N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide?
N-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide 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-(4-chlorophenyl)-6-fluoroquinoline-7-carboxamide is sourced from PubChem (CID 142343829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).