N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide

C23H16ClFN2O — CID 8966981

IUPACN-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cc(-c3ccccc3F)c3cc(Cl)ccc3n2)c1
InChIInChI=1S/C23H16ClFN2O/c1-14(28)26-17-6-4-5-15(11-17)23-13-19(18-7-2-3-8-21(18)25)20-12-16(24)9-10-22(20)27-23/h2-13H,1H3,(H,26,28)
InChIKeyBLPXAXWMLDKNCL-UHFFFAOYSA-N
MW390.85 g/mol
LogP6.32
Rot. Bonds3

About N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide

N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide (PubChem CID 8966981) has the molecular formula C23H16ClFN2O and a molecular weight of 390.85 g/mol. Its IUPAC name is N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide
PubChem CID8966981
Molecular FormulaC23H16ClFN2O
Molecular Weight390.85 g/mol
Exact Mass390.09
IUPAC NameN-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cc(-c3ccccc3F)c3cc(Cl)ccc3n2)c1
InChIInChI=1S/C23H16ClFN2O/c1-14(28)26-17-6-4-5-15(11-17)23-13-19(18-7-2-3-8-21(18)25)20-12-16(24)9-10-22(20)27-23/h2-13H,1H3,(H,26,28)
InChIKeyBLPXAXWMLDKNCL-UHFFFAOYSA-N
XLogP6.32
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.85
LogP ≤ 56.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide 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

3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenol
CID 8966921
2-(1,3-benzodioxol-5-yl)-6-chloro-4-(2-fluorophenyl)quinoline
CID 8966961
N-[3-(5-chloro-2-hydroxyphenyl)phenyl]acetamide
CID 134858754
6-chloro-4-(2-fluorophenyl)-2-(2-nitrophenyl)quinoline;hydrochloride
CID 75401799
7-acetamido-2-(2-fluorophenyl)quinoline-4-carboxylic acid
CID 18073623
6-acetamido-2-(4-chlorophenyl)quinoline-4-carboxylic acid
CID 18073438
N-(3-chlorophenyl)acetamide;N-phenylacetamide
CID 160915382
6-chloro-2-(3-methylphenyl)quinoline-4-carboxylic acid
CID 3348265
3-(6-chloro-4-phenylquinolin-2-yl)aniline;hydrochloride
CID 18285323
N-(4-chloro-2-fluorophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4196964
N-[3-[2-(2-fluorophenyl)quinazolin-4-yl]oxyphenyl]acetamide
CID 2929675
6-acetamido-2-[3-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid
CID 18073448

Frequently Asked Questions

What is the IUPAC name of N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide?
The IUPAC name of N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide (CID 8966981) is N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide is CC(=O)Nc1cccc(-c2cc(-c3ccccc3F)c3cc(Cl)ccc3n2)c1.
What is the InChIKey of N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide?
The InChIKey is BLPXAXWMLDKNCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16ClFN2O/c1-14(28)26-17-6-4-5-15(11-17)23-13-19(18-7-2-3-8-21(18)25)20-12-16(24)9-10-22(20)27-23/h2-13H,1H3,(H,26,28).
What are the key properties of N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide?
N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide has a molecular weight of 390.85 g/mol, XLogP of 6.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[6-chloro-4-(2-fluorophenyl)quinolin-2-yl]phenyl]acetamide is sourced from PubChem (CID 8966981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).