2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide

C8H10ClN3O4S — CID 64607870

IUPAC2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide
SMILESCNC(=O)CNS(=O)(=O)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C8H10ClN3O4S/c1-10-7(13)4-12-17(15,16)5-2-6(9)8(14)11-3-5/h2-3,12H,4H2,1H3,(H,10,13)(H,11,14)
InChIKeyKXDVUKGLAJZNJI-UHFFFAOYSA-N
MW279.71 g/mol
LogP-0.95
Rot. Bonds4

About 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide

2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide (PubChem CID 64607870) has the molecular formula C8H10ClN3O4S and a molecular weight of 279.71 g/mol. Its IUPAC name is 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide
PubChem CID64607870
Molecular FormulaC8H10ClN3O4S
Molecular Weight279.71 g/mol
Exact Mass279.01
IUPAC Name2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide
SMILESCNC(=O)CNS(=O)(=O)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C8H10ClN3O4S/c1-10-7(13)4-12-17(15,16)5-2-6(9)8(14)11-3-5/h2-3,12H,4H2,1H3,(H,10,13)(H,11,14)
InChIKeyKXDVUKGLAJZNJI-UHFFFAOYSA-N
XLogP-0.95
TPSA108.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.71
LogP ≤ 5-0.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]acetic acid
CID 64606557
N-[2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]ethyl]-2-methylpropanamide
CID 64608272
5-chloro-N-(4-hydroxy-2-methylbutyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 66107588
5-chloro-N-(3-hydroxy-2,2-dimethylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 115361937
5-chloro-N-(2-methoxypropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 102700034
3-[2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]ethyl]-1,1-dimethylurea
CID 83114327
2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]propanoic acid
CID 64608093
5-chloro-N-(2-methoxy-2-methylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 113450761
5-chloro-N-(4-hydroxybutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 83186740
5-chloro-N-(2-hydroxy-3-methoxypropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64608871
2-chloro-5-[[2-(methylamino)-2-oxoethyl]sulfamoyl]benzoic acid
CID 43214152
5-chloro-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 106149451

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide?
The IUPAC name of 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide (CID 64607870) is 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide?
The canonical SMILES for 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide is CNC(=O)CNS(=O)(=O)c1c[nH]c(=O)c(Cl)c1.
What is the InChIKey of 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide?
The InChIKey is KXDVUKGLAJZNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O4S/c1-10-7(13)4-12-17(15,16)5-2-6(9)8(14)11-3-5/h2-3,12H,4H2,1H3,(H,10,13)(H,11,14).
What are the key properties of 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide?
2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide has a molecular weight of 279.71 g/mol, XLogP of -0.95, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonylamino]-N-methylacetamide is sourced from PubChem (CID 64607870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).