6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide

C10H15ClN2O3S — CID 107317222

IUPAC6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCCCCCO)c1ccc(Cl)nc1
InChIInChI=1S/C10H15ClN2O3S/c11-10-5-4-9(8-12-10)17(15,16)13-6-2-1-3-7-14/h4-5,8,13-14H,1-3,6-7H2
InChIKeyPONUJZQLHRUNFD-UHFFFAOYSA-N
MW278.76 g/mol
LogP1.18
Rot. Bonds7

About 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide

6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide (PubChem CID 107317222) has the molecular formula C10H15ClN2O3S and a molecular weight of 278.76 g/mol. Its IUPAC name is 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide
PubChem CID107317222
Molecular FormulaC10H15ClN2O3S
Molecular Weight278.76 g/mol
Exact Mass278.05
IUPAC Name6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCCCCCO)c1ccc(Cl)nc1
InChIInChI=1S/C10H15ClN2O3S/c11-10-5-4-9(8-12-10)17(15,16)13-6-2-1-3-7-14/h4-5,8,13-14H,1-3,6-7H2
InChIKeyPONUJZQLHRUNFD-UHFFFAOYSA-N
XLogP1.18
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.76
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-(2-hydroxyethyl)pyridine-3-sulfonamide
CID 4862052
6-chloro-N-[3-[(6-chloro-3-pyridinyl)sulfonylamino]propyl]pyridine-3-sulfonamide
CID 4729949
6-chloro-N-(5-hydroxy-2,2-dimethylpentyl)pyridine-3-sulfonamide
CID 113347931
2-chloro-N-(4-hydroxybutyl)pyridine-4-sulfonamide
CID 106841570
N-[2-[(6-chloro-3-pyridinyl)sulfonylamino]ethyl]acetamide
CID 26943001
4-amino-N-(5-hydroxypentyl)benzenesulfonamide
CID 107316374
6-chloro-N-[3-(N-methylanilino)propyl]pyridine-3-sulfonamide
CID 26945524
3-chloro-N-(5-hydroxypentyl)benzenesulfonamide
CID 69467627
4-chloro-N-(3-hydroxypropyl)benzenesulfonamide
CID 5127490
6-chloro-N-[3-(4-fluorophenoxy)propyl]pyridine-3-sulfonamide
CID 110307295
6-chloro-N-(3-pyridin-3-ylpropyl)pyridine-3-sulfonamide
CID 110408505
6-chloro-N-(3-imidazol-1-ylpropyl)pyridine-3-sulfonamide
CID 28828807

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide?
The IUPAC name of 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide (CID 107317222) is 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide is O=S(=O)(NCCCCCO)c1ccc(Cl)nc1.
What is the InChIKey of 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide?
The InChIKey is PONUJZQLHRUNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O3S/c11-10-5-4-9(8-12-10)17(15,16)13-6-2-1-3-7-14/h4-5,8,13-14H,1-3,6-7H2.
What are the key properties of 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide?
6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide has a molecular weight of 278.76 g/mol, XLogP of 1.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-hydroxypentyl)pyridine-3-sulfonamide is sourced from PubChem (CID 107317222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).