2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide

C10H15N3O3S — CID 55119398

IUPAC2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide
SMILESNc1cc(S(=O)(=O)NCC2CCOC2)ccn1
InChIInChI=1S/C10H15N3O3S/c11-10-5-9(1-3-12-10)17(14,15)13-6-8-2-4-16-7-8/h1,3,5,8,13H,2,4,6-7H2,(H2,11,12)
InChIKeyPWQDOKFZOIKELP-UHFFFAOYSA-N
MW257.31 g/mol
LogP-0.02
Rot. Bonds4

About 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide

2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide (PubChem CID 55119398) has the molecular formula C10H15N3O3S and a molecular weight of 257.31 g/mol. Its IUPAC name is 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide
PubChem CID55119398
Molecular FormulaC10H15N3O3S
Molecular Weight257.31 g/mol
Exact Mass257.08
IUPAC Name2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide
SMILESNc1cc(S(=O)(=O)NCC2CCOC2)ccn1
InChIInChI=1S/C10H15N3O3S/c11-10-5-9(1-3-12-10)17(14,15)13-6-8-2-4-16-7-8/h1,3,5,8,13H,2,4,6-7H2,(H2,11,12)
InChIKeyPWQDOKFZOIKELP-UHFFFAOYSA-N
XLogP-0.02
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 61114420
N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 47203502
2-amino-N-(oxolan-3-ylmethyl)pyridine-3-sulfonamide
CID 62825249
N-(oxolan-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 47203478
3-amino-5-methyl-N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 61116503
3,4-dimethoxy-N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 47203510
4-bromo-3-fluoro-N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 103697478
N-(oxolan-3-ylmethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 62823134
N-[[(3R)-oxolan-3-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide
CID 94061219
4-ethoxy-3-methyl-N-[[(3R)-oxolan-3-yl]methyl]benzenesulfonamide
CID 95126815
3-amino-4-hydroxy-N-(oxan-3-ylmethyl)benzenesulfonamide
CID 61126988
3-amino-4-bromo-N-(oxan-3-ylmethyl)benzenesulfonamide
CID 115329018

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide?
The IUPAC name of 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide (CID 55119398) is 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide is Nc1cc(S(=O)(=O)NCC2CCOC2)ccn1.
What is the InChIKey of 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide?
The InChIKey is PWQDOKFZOIKELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c11-10-5-9(1-3-12-10)17(14,15)13-6-8-2-4-16-7-8/h1,3,5,8,13H,2,4,6-7H2,(H2,11,12).
What are the key properties of 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide?
2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide has a molecular weight of 257.31 g/mol, XLogP of -0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(oxolan-3-ylmethyl)pyridine-4-sulfonamide is sourced from PubChem (CID 55119398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).