6-chloro-N-quinolin-3-ylpyridine-3-carboxamide

C15H10ClN3O — CID 29330391

IUPAC6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccc(Cl)nc1
InChIInChI=1S/C15H10ClN3O/c16-14-6-5-11(8-18-14)15(20)19-12-7-10-3-1-2-4-13(10)17-9-12/h1-9H,(H,19,20)
InChIKeyFYAUXNNZULKLAX-UHFFFAOYSA-N
MW283.72 g/mol
LogP3.54
Rot. Bonds2

About 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide

6-chloro-N-quinolin-3-ylpyridine-3-carboxamide (PubChem CID 29330391) has the molecular formula C15H10ClN3O and a molecular weight of 283.72 g/mol. Its IUPAC name is 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
PubChem CID29330391
Molecular FormulaC15H10ClN3O
Molecular Weight283.72 g/mol
Exact Mass283.05
IUPAC Name6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccc(Cl)nc1
InChIInChI=1S/C15H10ClN3O/c16-14-6-5-11(8-18-14)15(20)19-12-7-10-3-1-2-4-13(10)17-9-12/h1-9H,(H,19,20)
InChIKeyFYAUXNNZULKLAX-UHFFFAOYSA-N
XLogP3.54
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-(methylamino)-N-quinolin-3-ylpyridine-3-carboxamide
CID 62808644
3-chloro-N-quinolin-3-ylbenzamide
CID 3284385
4-methyl-N-quinolin-3-ylbenzamide
CID 974969
4-bromo-N-quinolin-3-ylbenzamide
CID 3301629
6-chloro-N-(2-chloropyrimidin-5-yl)pyridine-3-carboxamide
CID 10125350
2-chloro-5-hydroxy-N-quinolin-3-ylbenzamide
CID 106501765
N-[3-(quinoline-3-carbonylamino)phenyl]quinoline-3-carboxamide
CID 171577203
3-amino-4-fluoro-N-quinolin-3-ylbenzamide
CID 61111864
N-(4-hydroxyphenyl)quinoline-3-carboxamide
CID 110489513
4-(methoxymethyl)-N-quinolin-3-ylbenzamide
CID 18153378
4-(2-methylbutan-2-yl)-N-quinolin-3-ylbenzamide
CID 66815675
6-[benzyl(methyl)amino]-N-quinolin-3-ylpyridine-3-carboxamide
CID 10451671

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide (CID 29330391) is 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide is O=C(Nc1cnc2ccccc2c1)c1ccc(Cl)nc1.
What is the InChIKey of 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide?
The InChIKey is FYAUXNNZULKLAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O/c16-14-6-5-11(8-18-14)15(20)19-12-7-10-3-1-2-4-13(10)17-9-12/h1-9H,(H,19,20).
What are the key properties of 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide?
6-chloro-N-quinolin-3-ylpyridine-3-carboxamide has a molecular weight of 283.72 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-quinolin-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 29330391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).