2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide

C11H13Cl2N3O — CID 2781660

IUPAC2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide
SMILESO=C(NN1CCCCC1)c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C11H13Cl2N3O/c12-9-6-8(7-10(13)14-9)11(17)15-16-4-2-1-3-5-16/h6-7H,1-5H2,(H,15,17)
InChIKeyBXIWHMGRSICIDP-UHFFFAOYSA-N
MW274.15 g/mol
LogP2.52
Rot. Bonds2

About 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide

2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide (PubChem CID 2781660) has the molecular formula C11H13Cl2N3O and a molecular weight of 274.15 g/mol. Its IUPAC name is 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide
PubChem CID2781660
Molecular FormulaC11H13Cl2N3O
Molecular Weight274.15 g/mol
Exact Mass273.04
IUPAC Name2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide
SMILESO=C(NN1CCCCC1)c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C11H13Cl2N3O/c12-9-6-8(7-10(13)14-9)11(17)15-16-4-2-1-3-5-16/h6-7H,1-5H2,(H,15,17)
InChIKeyBXIWHMGRSICIDP-UHFFFAOYSA-N
XLogP2.52
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.15
LogP ≤ 52.52
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

2,6-dichloro-N-(2,6-dimethylpiperidin-1-yl)pyridine-4-carboxamide
CID 78907821
3-chloro-N-pyrrolidin-1-ylbenzamide
CID 54164805
2,6-dichloro-N-cyclohexylpyridine-4-carboxamide
CID 26719449
2,6-dichloro-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 115596719
3-hydroxy-4-methyl-N-piperidin-1-ylbenzamide
CID 115279771
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,6-dichloropyridine-4-carboxamide
CID 61041996
4-chloro-6-methyl-N-piperidin-1-ylpyridine-3-carboxamide
CID 82843411
3-amino-5-fluoro-4-methyl-N-piperidin-1-ylbenzamide
CID 83013511
5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide
CID 83023979
2,6-dichloro-N-(1-methylcyclobutyl)pyridine-4-carboxamide
CID 115766201
2,6-dichloro-N-(1-cyanocycloheptyl)pyridine-4-carboxamide
CID 60966983
3-fluoro-4-methyl-N-piperidin-1-ylbenzamide
CID 9083904

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide?
The IUPAC name of 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide (CID 2781660) is 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide.
What is the SMILES notation for 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide?
The canonical SMILES for 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide is O=C(NN1CCCCC1)c1cc(Cl)nc(Cl)c1.
What is the InChIKey of 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide?
The InChIKey is BXIWHMGRSICIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2N3O/c12-9-6-8(7-10(13)14-9)11(17)15-16-4-2-1-3-5-16/h6-7H,1-5H2,(H,15,17).
What are the key properties of 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide?
2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide has a molecular weight of 274.15 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-piperidin-1-ylpyridine-4-carboxamide is sourced from PubChem (CID 2781660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).