4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide

C12H19N3O2S — CID 64923066

IUPAC4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2cnccc2N)C1C
InChIInChI=1S/C12H19N3O2S/c1-8-3-4-11(9(8)2)15-18(16,17)12-7-14-6-5-10(12)13/h5-9,11,15H,3-4H2,1-2H3,(H2,13,14)
InChIKeyKIJPDTAOPZTNFC-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.38
Rot. Bonds3

About 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide

4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide (PubChem CID 64923066) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
PubChem CID64923066
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2cnccc2N)C1C
InChIInChI=1S/C12H19N3O2S/c1-8-3-4-11(9(8)2)15-18(16,17)12-7-14-6-5-10(12)13/h5-9,11,15H,3-4H2,1-2H3,(H2,13,14)
InChIKeyKIJPDTAOPZTNFC-UHFFFAOYSA-N
XLogP1.38
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide?
The IUPAC name of 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide (CID 64923066) is 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide.
What is the SMILES notation for 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide?
The canonical SMILES for 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide is CC1CCC(NS(=O)(=O)c2cnccc2N)C1C.
What is the InChIKey of 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide?
The InChIKey is KIJPDTAOPZTNFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8-3-4-11(9(8)2)15-18(16,17)12-7-14-6-5-10(12)13/h5-9,11,15H,3-4H2,1-2H3,(H2,13,14).
What are the key properties of 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide?
4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide has a molecular weight of 269.37 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64923066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).