6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide

C13H20ClN3O2S — CID 106014920

IUPAC6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)NCCCC2CCCC2)cc1Cl
InChIInChI=1S/C13H20ClN3O2S/c14-12-8-11(9-16-13(12)15)20(18,19)17-7-3-6-10-4-1-2-5-10/h8-10,17H,1-7H2,(H2,15,16)
InChIKeyOMJLWIWIIDXAOK-UHFFFAOYSA-N
MW317.84 g/mol
LogP2.57
Rot. Bonds6

About 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide

6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide (PubChem CID 106014920) has the molecular formula C13H20ClN3O2S and a molecular weight of 317.84 g/mol. Its IUPAC name is 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide
PubChem CID106014920
Molecular FormulaC13H20ClN3O2S
Molecular Weight317.84 g/mol
Exact Mass317.10
IUPAC Name6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)NCCCC2CCCC2)cc1Cl
InChIInChI=1S/C13H20ClN3O2S/c14-12-8-11(9-16-13(12)15)20(18,19)17-7-3-6-10-4-1-2-5-10/h8-10,17H,1-7H2,(H2,15,16)
InChIKeyOMJLWIWIIDXAOK-UHFFFAOYSA-N
XLogP2.57
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.84
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-amino-5-chloro-N-(3-methylsulfonylpropyl)pyridine-3-sulfonamide
CID 64602641
5-chloro-N-(2-cyclobutylethyl)-6-hydrazinylpyridine-3-sulfonamide
CID 113479037
5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64600883
4-(aminomethyl)-3-chloro-N-(3-cyclopentylpropyl)benzenesulfonamide
CID 106016313
6-amino-5-chloro-N-(oxan-3-ylmethyl)pyridine-3-sulfonamide
CID 64601682
6-amino-5-chloro-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-sulfonamide
CID 64601870
6-amino-5-chloro-N-(oxan-4-ylmethyl)pyridine-3-sulfonamide
CID 64602485
3-bromo-4-chloro-N-(3-cyclopentylpropyl)benzenesulfonamide
CID 106012518
5-amino-2-chloro-N-(3-cyclopentylpropyl)benzenesulfonamide
CID 106006680
6-amino-5-chloro-N-cyclopropylpyridine-3-sulfonamide
CID 64607555
6-amino-5-chloro-N-(2-methylpropyl)pyridine-3-sulfonamide
CID 64607743
6-amino-5-chloro-N-(2-methylcyclohexyl)pyridine-3-sulfonamide
CID 64608315

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide (CID 106014920) is 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide is Nc1ncc(S(=O)(=O)NCCCC2CCCC2)cc1Cl.
What is the InChIKey of 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide?
The InChIKey is OMJLWIWIIDXAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O2S/c14-12-8-11(9-16-13(12)15)20(18,19)17-7-3-6-10-4-1-2-5-10/h8-10,17H,1-7H2,(H2,15,16).
What are the key properties of 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide?
6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide has a molecular weight of 317.84 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide is sourced from PubChem (CID 106014920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).