N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide

C11H14BrN3O — CID 43114372

IUPACN-(5-bromo-2-pyridinyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cn1)C1CCCNC1
InChIInChI=1S/C11H14BrN3O/c12-9-3-4-10(14-7-9)15-11(16)8-2-1-5-13-6-8/h3-4,7-8,13H,1-2,5-6H2,(H,14,15,16)
InChIKeyLURZDHQDKHLCGG-UHFFFAOYSA-N
MW284.16 g/mol
LogP1.78
Rot. Bonds2

About N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide

N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide (PubChem CID 43114372) has the molecular formula C11H14BrN3O and a molecular weight of 284.16 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)piperidine-3-carboxamide
PubChem CID43114372
Molecular FormulaC11H14BrN3O
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC NameN-(5-bromo-2-pyridinyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cn1)C1CCCNC1
InChIInChI=1S/C11H14BrN3O/c12-9-3-4-10(14-7-9)15-11(16)8-2-1-5-13-6-8/h3-4,7-8,13H,1-2,5-6H2,(H,14,15,16)
InChIKeyLURZDHQDKHLCGG-UHFFFAOYSA-N
XLogP1.78
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.16
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide (CID 43114372) is N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide is O=C(Nc1ccc(Br)cn1)C1CCCNC1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide?
The InChIKey is LURZDHQDKHLCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O/c12-9-3-4-10(14-7-9)15-11(16)8-2-1-5-13-6-8/h3-4,7-8,13H,1-2,5-6H2,(H,14,15,16).
What are the key properties of N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide?
N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide has a molecular weight of 284.16 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)piperidine-3-carboxamide is sourced from PubChem (CID 43114372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).