N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide

C15H23N3O4S — CID 36674228

IUPACN-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide
SMILESCCN1CCC(NC(=O)c2cc(S(N)(=O)=O)ccc2OC)CC1
InChIInChI=1S/C15H23N3O4S/c1-3-18-8-6-11(7-9-18)17-15(19)13-10-12(23(16,20)21)4-5-14(13)22-2/h4-5,10-11H,3,6-9H2,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyXCHIBKIKADSEJL-UHFFFAOYSA-N
MW341.43 g/mol
LogP0.56
Rot. Bonds5

About N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide

N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide (PubChem CID 36674228) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide
PubChem CID36674228
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC NameN-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide
SMILESCCN1CCC(NC(=O)c2cc(S(N)(=O)=O)ccc2OC)CC1
InChIInChI=1S/C15H23N3O4S/c1-3-18-8-6-11(7-9-18)17-15(19)13-10-12(23(16,20)21)4-5-14(13)22-2/h4-5,10-11H,3,6-9H2,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyXCHIBKIKADSEJL-UHFFFAOYSA-N
XLogP0.56
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide (CID 36674228) is N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide is CCN1CCC(NC(=O)c2cc(S(N)(=O)=O)ccc2OC)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide?
The InChIKey is XCHIBKIKADSEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S/c1-3-18-8-6-11(7-9-18)17-15(19)13-10-12(23(16,20)21)4-5-14(13)22-2/h4-5,10-11H,3,6-9H2,1-2H3,(H,17,19)(H2,16,20,21).
What are the key properties of N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide?
N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide has a molecular weight of 341.43 g/mol, XLogP of 0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-2-methoxy-5-sulfamoylbenzamide is sourced from PubChem (CID 36674228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).