N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide

C15H24N2O5S — CID 7618000

IUPACN-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide
SMILESCCOCCCNS(=O)(=O)CCNC(=O)c1cccc(OC)c1
InChIInChI=1S/C15H24N2O5S/c1-3-22-10-5-8-17-23(19,20)11-9-16-15(18)13-6-4-7-14(12-13)21-2/h4,6-7,12,17H,3,5,8-11H2,1-2H3,(H,16,18)
InChIKeyGCIJFUNDRLLTSP-UHFFFAOYSA-N
MW344.43 g/mol
LogP0.77
Rot. Bonds11

About N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide

N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide (PubChem CID 7618000) has the molecular formula C15H24N2O5S and a molecular weight of 344.43 g/mol. Its IUPAC name is N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide
PubChem CID7618000
Molecular FormulaC15H24N2O5S
Molecular Weight344.43 g/mol
Exact Mass344.14
IUPAC NameN-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide
SMILESCCOCCCNS(=O)(=O)CCNC(=O)c1cccc(OC)c1
InChIInChI=1S/C15H24N2O5S/c1-3-22-10-5-8-17-23(19,20)11-9-16-15(18)13-6-4-7-14(12-13)21-2/h4,6-7,12,17H,3,5,8-11H2,1-2H3,(H,16,18)
InChIKeyGCIJFUNDRLLTSP-UHFFFAOYSA-N
XLogP0.77
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide
CID 18582832
2-[2-[(3-methoxybenzoyl)amino]ethylsulfonylamino]ethyl-dimethylazanium
CID 7618004
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030
N-[2-(cycloheptylsulfamoyl)ethyl]-3-methoxybenzamide
CID 7618048
N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 40718415
N-(3-ethoxypropyl)-2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
CID 17226286
3-methoxy-N-tridecylbenzamide
CID 139819898
3,4-dimethoxy-N-[2-[2-(3-methoxyphenyl)ethylsulfamoyl]ethyl]benzamide
CID 7618938
N-[2-(ethylsulfamoyl)ethyl]-3,5-dimethoxybenzamide
CID 7619023
3,4-dimethoxy-N-[2-[(3-methoxyphenyl)methylsulfamoyl]ethyl]benzamide
CID 7618936
3-methoxy-N-[3-(3-methylphenoxy)propyl]benzamide
CID 24533352
N-[2-(dimethylsulfamoylamino)ethyl]-3-methoxybenzamide
CID 35325375

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide?
The IUPAC name of N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide (CID 7618000) is N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide.
What is the SMILES notation for N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide?
The canonical SMILES for N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide is CCOCCCNS(=O)(=O)CCNC(=O)c1cccc(OC)c1.
What is the InChIKey of N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide?
The InChIKey is GCIJFUNDRLLTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O5S/c1-3-22-10-5-8-17-23(19,20)11-9-16-15(18)13-6-4-7-14(12-13)21-2/h4,6-7,12,17H,3,5,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide?
N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide has a molecular weight of 344.43 g/mol, XLogP of 0.77, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethoxypropylsulfamoyl)ethyl]-3-methoxybenzamide is sourced from PubChem (CID 7618000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).