3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide

C15H24N2O4S — CID 18582832

IUPAC3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide
SMILESCCCCCNS(=O)(=O)CCNC(=O)c1cccc(OC)c1
InChIInChI=1S/C15H24N2O4S/c1-3-4-5-9-17-22(19,20)11-10-16-15(18)13-7-6-8-14(12-13)21-2/h6-8,12,17H,3-5,9-11H2,1-2H3,(H,16,18)
InChIKeyRHKZGZMGVWIPSU-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.53
Rot. Bonds10

About 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide

3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide (PubChem CID 18582832) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide
PubChem CID18582832
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC Name3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide
SMILESCCCCCNS(=O)(=O)CCNC(=O)c1cccc(OC)c1
InChIInChI=1S/C15H24N2O4S/c1-3-4-5-9-17-22(19,20)11-10-16-15(18)13-7-6-8-14(12-13)21-2/h6-8,12,17H,3-5,9-11H2,1-2H3,(H,16,18)
InChIKeyRHKZGZMGVWIPSU-UHFFFAOYSA-N
XLogP1.53
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide
CID 7618000
3-methoxy-N-tridecylbenzamide
CID 139819898
2-[2-[(3-methoxybenzoyl)amino]ethylsulfonylamino]ethyl-dimethylazanium
CID 7618004
3,4-dimethoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide
CID 7618935
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030
N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 40718415
N-[2-(cycloheptylsulfamoyl)ethyl]-3-methoxybenzamide
CID 7618048
N-(6-bromohexyl)-3-methoxybenzamide
CID 114008510
3,4-dimethoxy-N-[2-[2-(3-methoxyphenyl)ethylsulfamoyl]ethyl]benzamide
CID 7618938
N-[2-(ethylsulfamoyl)ethyl]-3,5-dimethoxybenzamide
CID 7619023
3-methoxy-N-(pentylcarbamothioyl)benzamide
CID 18822983
N-[2-[acetyl(pentyl)amino]ethyl]-3-methoxybenzamide
CID 113056954

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide?
The IUPAC name of 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide (CID 18582832) is 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide is CCCCCNS(=O)(=O)CCNC(=O)c1cccc(OC)c1.
What is the InChIKey of 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide?
The InChIKey is RHKZGZMGVWIPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-3-4-5-9-17-22(19,20)11-10-16-15(18)13-7-6-8-14(12-13)21-2/h6-8,12,17H,3-5,9-11H2,1-2H3,(H,16,18).
What are the key properties of 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide?
3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide has a molecular weight of 328.43 g/mol, XLogP of 1.53, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide is sourced from PubChem (CID 18582832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).