6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide

C11H19N3O3S — CID 114613742

IUPAC6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide
SMILESCCOC(C)CNS(=O)(=O)c1ccc(CN)nc1
InChIInChI=1S/C11H19N3O3S/c1-3-17-9(2)7-14-18(15,16)11-5-4-10(6-12)13-8-11/h4-5,8-9,14H,3,6-7,12H2,1-2H3
InChIKeyDYCUTKPJXBLCEF-UHFFFAOYSA-N
MW273.36 g/mol
LogP0.24
Rot. Bonds7

About 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide

6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide (PubChem CID 114613742) has the molecular formula C11H19N3O3S and a molecular weight of 273.36 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide
PubChem CID114613742
Molecular FormulaC11H19N3O3S
Molecular Weight273.36 g/mol
Exact Mass273.11
IUPAC Name6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide
SMILESCCOC(C)CNS(=O)(=O)c1ccc(CN)nc1
InChIInChI=1S/C11H19N3O3S/c1-3-17-9(2)7-14-18(15,16)11-5-4-10(6-12)13-8-11/h4-5,8-9,14H,3,6-7,12H2,1-2H3
InChIKeyDYCUTKPJXBLCEF-UHFFFAOYSA-N
XLogP0.24
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(2-ethoxypropyl)benzene-1,4-disulfonamide
CID 115650655
4-(2-aminoethoxy)-N-(2-ethoxypropyl)benzenesulfonamide
CID 106078716
6-(aminomethyl)-N-(2-phenylpropyl)pyridine-3-sulfonamide
CID 114613731
3-(aminomethyl)-4-chloro-N-(2-ethoxypropyl)benzenesulfonamide
CID 106078885
N-(2-ethoxypropyl)-4-methoxybenzenesulfonamide
CID 166983040
6-(aminomethyl)-N-(4-ethoxyphenyl)pyridine-3-sulfonamide
CID 114613079
5-(aminomethyl)-N-(2-ethoxypropyl)thiophene-3-sulfonamide
CID 114142018
6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)pyridine-3-sulfonamide
CID 114613735
2-[[6-(aminomethyl)-3-pyridinyl]sulfonylamino]-N,N-diethylacetamide
CID 114613706
3-[[6-(aminomethyl)-3-pyridinyl]sulfonylamino]-N-butan-2-ylpropanamide
CID 114613390
5-(aminomethyl)-N-(2-ethoxypropyl)-2-ethylbenzenesulfonamide
CID 106078747
6-(aminomethyl)-N-(2-sulfamoylethyl)pyridine-3-sulfonamide
CID 114613166

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide (CID 114613742) is 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide is CCOC(C)CNS(=O)(=O)c1ccc(CN)nc1.
What is the InChIKey of 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide?
The InChIKey is DYCUTKPJXBLCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S/c1-3-17-9(2)7-14-18(15,16)11-5-4-10(6-12)13-8-11/h4-5,8-9,14H,3,6-7,12H2,1-2H3.
What are the key properties of 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide?
6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide has a molecular weight of 273.36 g/mol, XLogP of 0.24, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide is sourced from PubChem (CID 114613742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).