3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide

C10H17N3O3S — CID 138585429

IUPAC3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide
SMILESCN(C)S(=O)(=O)CCCn1cccc(N)c1=O
InChIInChI=1S/C10H17N3O3S/c1-12(2)17(15,16)8-4-7-13-6-3-5-9(11)10(13)14/h3,5-6H,4,7-8,11H2,1-2H3
InChIKeyYGVFFUHUOSJYAI-UHFFFAOYSA-N
MW259.33 g/mol
LogP-0.29
Rot. Bonds5

About 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide

3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide (PubChem CID 138585429) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide.

Molecular Properties

Compound Name3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide
PubChem CID138585429
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC Name3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide
SMILESCN(C)S(=O)(=O)CCCn1cccc(N)c1=O
InChIInChI=1S/C10H17N3O3S/c1-12(2)17(15,16)8-4-7-13-6-3-5-9(11)10(13)14/h3,5-6H,4,7-8,11H2,1-2H3
InChIKeyYGVFFUHUOSJYAI-UHFFFAOYSA-N
XLogP-0.29
TPSA85.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide?
The IUPAC name of 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide (CID 138585429) is 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide.
What is the SMILES notation for 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide?
The canonical SMILES for 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide is CN(C)S(=O)(=O)CCCn1cccc(N)c1=O.
What is the InChIKey of 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide?
The InChIKey is YGVFFUHUOSJYAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-12(2)17(15,16)8-4-7-13-6-3-5-9(11)10(13)14/h3,5-6H,4,7-8,11H2,1-2H3.
What are the key properties of 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide?
3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide has a molecular weight of 259.33 g/mol, XLogP of -0.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-amino-2-oxo-1-pyridinyl)-N,N-dimethylpropane-1-sulfonamide is sourced from PubChem (CID 138585429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).