N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide

C15H25N3O5S — CID 7618827

IUPACN-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCCS(=O)(=O)NCCN(C)C)cc1OC
InChIInChI=1S/C15H25N3O5S/c1-18(2)9-7-17-24(20,21)10-8-16-15(19)12-5-6-13(22-3)14(11-12)23-4/h5-6,11,17H,7-10H2,1-4H3,(H,16,19)
InChIKeyLVNKFGPMFMBTAG-UHFFFAOYSA-N
MW359.45 g/mol
LogP-0.09
Rot. Bonds10

About N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide

N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide (PubChem CID 7618827) has the molecular formula C15H25N3O5S and a molecular weight of 359.45 g/mol. Its IUPAC name is N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide
PubChem CID7618827
Molecular FormulaC15H25N3O5S
Molecular Weight359.45 g/mol
Exact Mass359.15
IUPAC NameN-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCCS(=O)(=O)NCCN(C)C)cc1OC
InChIInChI=1S/C15H25N3O5S/c1-18(2)9-7-17-24(20,21)10-8-16-15(19)12-5-6-13(22-3)14(11-12)23-4/h5-6,11,17H,7-10H2,1-4H3,(H,16,19)
InChIKeyLVNKFGPMFMBTAG-UHFFFAOYSA-N
XLogP-0.09
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3,4-dimethoxy-N-[2-(pentylsulfamoyl)ethyl]benzamide
CID 7618935
N-[2-[3-(dimethylamino)propylsulfamoyl]ethyl]-4-methoxybenzamide
CID 7618197
3,4-dimethoxy-N-[2-(3-phenylpropylsulfamoyl)ethyl]benzamide
CID 7618926
ethyl 2-[2-[(3,4-dimethoxybenzoyl)amino]ethylsulfonylamino]acetate
CID 7618819
3,4-dimethoxy-N-[2-[2-(3-methoxyphenyl)ethylsulfamoyl]ethyl]benzamide
CID 7618938
N-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]-3,4-dimethoxybenzamide
CID 112991429
N-[2-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]ethyl]-4-methoxybenzamide
CID 7618251
3,4-dimethoxy-N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide
CID 7618911
3,4-dimethoxy-N-[2-[(3-methoxyphenyl)methylsulfamoyl]ethyl]benzamide
CID 7618936
3,4-dimethoxy-N-[2-(3-morpholin-4-ylpropylsulfamoyl)ethyl]benzamide
CID 7618847
N-[2-(dimethylamino)ethyl]-4-(hydroxyamino)-3-methoxybenzamide
CID 89277781
N-[2-(cyclohexylsulfamoyl)ethyl]-3,4-dimethoxybenzamide
CID 7618852

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide?
The IUPAC name of N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide (CID 7618827) is N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide.
What is the SMILES notation for N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide?
The canonical SMILES for N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide is COc1ccc(C(=O)NCCS(=O)(=O)NCCN(C)C)cc1OC.
What is the InChIKey of N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide?
The InChIKey is LVNKFGPMFMBTAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O5S/c1-18(2)9-7-17-24(20,21)10-8-16-15(19)12-5-6-13(22-3)14(11-12)23-4/h5-6,11,17H,7-10H2,1-4H3,(H,16,19).
What are the key properties of N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide?
N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide has a molecular weight of 359.45 g/mol, XLogP of -0.09, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(dimethylamino)ethylsulfamoyl]ethyl]-3,4-dimethoxybenzamide is sourced from PubChem (CID 7618827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).