N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide

C17H12ClFN2O — CID 24663705

IUPACN-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide
SMILESO=C(Cc1cccc2cccnc12)Nc1ccc(Cl)cc1F
InChIInChI=1S/C17H12ClFN2O/c18-13-6-7-15(14(19)10-13)21-16(22)9-12-4-1-3-11-5-2-8-20-17(11)12/h1-8,10H,9H2,(H,21,22)
InChIKeyBUQJIUXKUABQIT-UHFFFAOYSA-N
MW314.75 g/mol
LogP4.21
Rot. Bonds3

About N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide

N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide (PubChem CID 24663705) has the molecular formula C17H12ClFN2O and a molecular weight of 314.75 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide
PubChem CID24663705
Molecular FormulaC17H12ClFN2O
Molecular Weight314.75 g/mol
Exact Mass314.06
IUPAC NameN-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide
SMILESO=C(Cc1cccc2cccnc12)Nc1ccc(Cl)cc1F
InChIInChI=1S/C17H12ClFN2O/c18-13-6-7-15(14(19)10-13)21-16(22)9-12-4-1-3-11-5-2-8-20-17(11)12/h1-8,10H,9H2,(H,21,22)
InChIKeyBUQJIUXKUABQIT-UHFFFAOYSA-N
XLogP4.21
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.75
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,4-difluorophenyl)-N'-quinolin-8-ylpropanediamide
CID 108956736
[(2S)-1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] quinoline-8-carboxylate
CID 9061886
N-(4-chloro-2-fluorophenyl)-2-pyrimidin-2-ylsulfanylacetamide
CID 743539
N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide
CID 51307005
5-chloro-2-fluoro-N-quinolin-8-ylbenzamide
CID 17416993
2-(3-fluorophenyl)-N-quinolin-8-ylacetamide
CID 17466971
N'-(2,5-difluorophenyl)-N-(quinolin-8-ylmethyl)oxamide
CID 86864531
N-[(2-chlorophenyl)methyl]-2-quinolin-8-ylacetamide
CID 51307001
N-(4-chloro-2-fluorophenyl)-2-(3-methylphenyl)acetamide
CID 6464374
N-(4-chloro-2-fluorophenyl)-2-(4-fluorophenyl)acetamide
CID 7961331
1-(4-chloro-2-methylphenyl)-3-quinolin-8-ylurea
CID 108991844
N-(2,5-dichlorophenyl)-2-(quinolin-8-ylamino)acetamide
CID 109010978

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide (CID 24663705) is N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide is O=C(Cc1cccc2cccnc12)Nc1ccc(Cl)cc1F.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide?
The InChIKey is BUQJIUXKUABQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClFN2O/c18-13-6-7-15(14(19)10-13)21-16(22)9-12-4-1-3-11-5-2-8-20-17(11)12/h1-8,10H,9H2,(H,21,22).
What are the key properties of N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide?
N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide has a molecular weight of 314.75 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide is sourced from PubChem (CID 24663705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).