3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide

C10H14ClN3O4S — CID 51092036

IUPAC3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide
SMILESCCOc1ccc(Cl)c(C(=O)NCCS(N)(=O)=O)n1
InChIInChI=1S/C10H14ClN3O4S/c1-2-18-8-4-3-7(11)9(14-8)10(15)13-5-6-19(12,16)17/h3-4H,2,5-6H2,1H3,(H,13,15)(H2,12,16,17)
InChIKeyYKEMTKVGUQTOHP-UHFFFAOYSA-N
MW307.76 g/mol
LogP0.15
Rot. Bonds6

About 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide

3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide (PubChem CID 51092036) has the molecular formula C10H14ClN3O4S and a molecular weight of 307.76 g/mol. Its IUPAC name is 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide
PubChem CID51092036
Molecular FormulaC10H14ClN3O4S
Molecular Weight307.76 g/mol
Exact Mass307.04
IUPAC Name3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide
SMILESCCOc1ccc(Cl)c(C(=O)NCCS(N)(=O)=O)n1
InChIInChI=1S/C10H14ClN3O4S/c1-2-18-8-4-3-7(11)9(14-8)10(15)13-5-6-19(12,16)17/h3-4H,2,5-6H2,1H3,(H,13,15)(H2,12,16,17)
InChIKeyYKEMTKVGUQTOHP-UHFFFAOYSA-N
XLogP0.15
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.76
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide (CID 51092036) is 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide is CCOc1ccc(Cl)c(C(=O)NCCS(N)(=O)=O)n1.
What is the InChIKey of 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The InChIKey is YKEMTKVGUQTOHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O4S/c1-2-18-8-4-3-7(11)9(14-8)10(15)13-5-6-19(12,16)17/h3-4H,2,5-6H2,1H3,(H,13,15)(H2,12,16,17).
What are the key properties of 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide has a molecular weight of 307.76 g/mol, XLogP of 0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-ethoxy-N-(2-sulfamoylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 51092036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).