3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide

C15H8Cl3N3O — CID 16549009

IUPAC3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1ncc(Cl)c(Cl)c1Cl
InChIInChI=1S/C15H8Cl3N3O/c16-9-7-20-14(12(18)11(9)17)15(22)21-10-5-1-3-8-4-2-6-19-13(8)10/h1-7H,(H,21,22)
InChIKeySCYIOBNDWFUSLF-UHFFFAOYSA-N
MW352.61 g/mol
LogP4.84
Rot. Bonds2

About 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide

3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide (PubChem CID 16549009) has the molecular formula C15H8Cl3N3O and a molecular weight of 352.61 g/mol. Its IUPAC name is 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide
PubChem CID16549009
Molecular FormulaC15H8Cl3N3O
Molecular Weight352.61 g/mol
Exact Mass350.97
IUPAC Name3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1ncc(Cl)c(Cl)c1Cl
InChIInChI=1S/C15H8Cl3N3O/c16-9-7-20-14(12(18)11(9)17)15(22)21-10-5-1-3-8-4-2-6-19-13(8)10/h1-7H,(H,21,22)
InChIKeySCYIOBNDWFUSLF-UHFFFAOYSA-N
XLogP4.84
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.61
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-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

3,4,5-trichloro-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 8714296
6-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103186933
5-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103817057
6-chloro-N-quinolin-8-ylpyridine-2-carboxamide
CID 62235243
N-quinolin-8-ylpyrazine-2-carboxamide
CID 139088852
2-[(3,4,5-trichloropyridine-2-carbonyl)amino]pyridine-3-carboxylic acid
CID 63653226
2-chloro-N-quinolin-8-ylfuran-3-carboxamide
CID 106685180
2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide
CID 23913298
5-(methylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 104639694
5-chloro-2-fluoro-N-quinolin-8-ylbenzamide
CID 17416993
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
6-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 66463068

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide?
The IUPAC name of 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide (CID 16549009) is 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide.
What is the SMILES notation for 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide?
The canonical SMILES for 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide is O=C(Nc1cccc2cccnc12)c1ncc(Cl)c(Cl)c1Cl.
What is the InChIKey of 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide?
The InChIKey is SCYIOBNDWFUSLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl3N3O/c16-9-7-20-14(12(18)11(9)17)15(22)21-10-5-1-3-8-4-2-6-19-13(8)10/h1-7H,(H,21,22).
What are the key properties of 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide?
3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide has a molecular weight of 352.61 g/mol, XLogP of 4.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trichloro-N-quinolin-8-ylpyridine-2-carboxamide is sourced from PubChem (CID 16549009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).