N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide

C10H14BrN3O2S — CID 3320967

IUPACN-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide
SMILESO=S(=O)(Nc1ccc(Br)cn1)N1CCCCC1
InChIInChI=1S/C10H14BrN3O2S/c11-9-4-5-10(12-8-9)13-17(15,16)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H,12,13)
InChIKeyQGAIGULGYCQYKX-UHFFFAOYSA-N
MW320.21 g/mol
LogP1.99
Rot. Bonds3

About N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide

N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide (PubChem CID 3320967) has the molecular formula C10H14BrN3O2S and a molecular weight of 320.21 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide
PubChem CID3320967
Molecular FormulaC10H14BrN3O2S
Molecular Weight320.21 g/mol
Exact Mass319.00
IUPAC NameN-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide
SMILESO=S(=O)(Nc1ccc(Br)cn1)N1CCCCC1
InChIInChI=1S/C10H14BrN3O2S/c11-9-4-5-10(12-8-9)13-17(15,16)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H,12,13)
InChIKeyQGAIGULGYCQYKX-UHFFFAOYSA-N
XLogP1.99
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.21
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide (CID 3320967) is N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide is O=S(=O)(Nc1ccc(Br)cn1)N1CCCCC1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide?
The InChIKey is QGAIGULGYCQYKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O2S/c11-9-4-5-10(12-8-9)13-17(15,16)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H,12,13).
What are the key properties of N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide?
N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide has a molecular weight of 320.21 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)piperidine-1-sulfonamide is sourced from PubChem (CID 3320967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).