N-(3,4-dichlorophenyl)quinoline-7-carboxamide

C16H10Cl2N2O — CID 142343714

IUPACN-(3,4-dichlorophenyl)quinoline-7-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccc2cccnc2c1
InChIInChI=1S/C16H10Cl2N2O/c17-13-6-5-12(9-14(13)18)20-16(21)11-4-3-10-2-1-7-19-15(10)8-11/h1-9H,(H,20,21)
InChIKeyCBWFENQLOHIMAI-UHFFFAOYSA-N
MW317.18 g/mol
LogP4.79
Rot. Bonds2

About N-(3,4-dichlorophenyl)quinoline-7-carboxamide

N-(3,4-dichlorophenyl)quinoline-7-carboxamide (PubChem CID 142343714) has the molecular formula C16H10Cl2N2O and a molecular weight of 317.18 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)quinoline-7-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)quinoline-7-carboxamide
PubChem CID142343714
Molecular FormulaC16H10Cl2N2O
Molecular Weight317.18 g/mol
Exact Mass316.02
IUPAC NameN-(3,4-dichlorophenyl)quinoline-7-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccc2cccnc2c1
InChIInChI=1S/C16H10Cl2N2O/c17-13-6-5-12(9-14(13)18)20-16(21)11-4-3-10-2-1-7-19-15(10)8-11/h1-9H,(H,20,21)
InChIKeyCBWFENQLOHIMAI-UHFFFAOYSA-N
XLogP4.79
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.18
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3,4-dichlorophenyl)quinoline-7-carboxamide 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-[3-chloro-4-(trifluoromethyl)phenyl]quinoline-7-carboxamide
CID 162607907
N-[4-chloro-3-(trifluoromethyl)phenyl]quinoline-7-carboxamide
CID 142343699
N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide
CID 142343740
3-(quinoline-7-carbonylamino)benzenesulfonic acid
CID 142343655
N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide
CID 58842913
N-(4-phenylsulfinamoylphenyl)quinoline-7-carboxamide
CID 166899812
N-[4-fluoro-3-(methylsulfamoyl)phenyl]quinoline-7-carboxamide
CID 142343698
N-(3,4-dichlorophenyl)pyrido[2,3-b]pyrazine-7-carboxamide
CID 110863997
N-quinolin-6-yl-2H-benzotriazole-5-carboxamide
CID 60555981
N-pyridin-4-ylquinoline-6-carboxamide
CID 53313330
N-quinolin-6-ylbenzamide
CID 833617
ethyl 2-fluoro-4-(quinoline-7-carbonylamino)benzoate
CID 68694892

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)quinoline-7-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)quinoline-7-carboxamide (CID 142343714) is N-(3,4-dichlorophenyl)quinoline-7-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)quinoline-7-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)quinoline-7-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc2cccnc2c1.
What is the InChIKey of N-(3,4-dichlorophenyl)quinoline-7-carboxamide?
The InChIKey is CBWFENQLOHIMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2O/c17-13-6-5-12(9-14(13)18)20-16(21)11-4-3-10-2-1-7-19-15(10)8-11/h1-9H,(H,20,21).
What are the key properties of N-(3,4-dichlorophenyl)quinoline-7-carboxamide?
N-(3,4-dichlorophenyl)quinoline-7-carboxamide has a molecular weight of 317.18 g/mol, XLogP of 4.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)quinoline-7-carboxamide is sourced from PubChem (CID 142343714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).