N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide

C10H14ClN3O2S — CID 104821271

IUPACN-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)n1)N1CCCCC1
InChIInChI=1S/C10H14ClN3O2S/c11-9-5-4-6-10(12-9)13-17(15,16)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2,(H,12,13)
InChIKeyMPNRFMSPLDEAKD-UHFFFAOYSA-N
MW275.76 g/mol
LogP1.88
Rot. Bonds3

About N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide

N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide (PubChem CID 104821271) has the molecular formula C10H14ClN3O2S and a molecular weight of 275.76 g/mol. Its IUPAC name is N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide
PubChem CID104821271
Molecular FormulaC10H14ClN3O2S
Molecular Weight275.76 g/mol
Exact Mass275.05
IUPAC NameN-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide
SMILESO=S(=O)(Nc1cccc(Cl)n1)N1CCCCC1
InChIInChI=1S/C10H14ClN3O2S/c11-9-5-4-6-10(12-9)13-17(15,16)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2,(H,12,13)
InChIKeyMPNRFMSPLDEAKD-UHFFFAOYSA-N
XLogP1.88
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.76
LogP ≤ 51.88
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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Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide?
The IUPAC name of N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide (CID 104821271) is N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide is O=S(=O)(Nc1cccc(Cl)n1)N1CCCCC1.
What is the InChIKey of N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide?
The InChIKey is MPNRFMSPLDEAKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O2S/c11-9-5-4-6-10(12-9)13-17(15,16)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2,(H,12,13).
What are the key properties of N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide?
N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide has a molecular weight of 275.76 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-2-pyridinyl)piperidine-1-sulfonamide is sourced from PubChem (CID 104821271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).