N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide

C19H33N3O3S — CID 55836803

IUPACN-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)N(CCN(CC)CC)CC(C)C)cc1
InChIInChI=1S/C19H33N3O3S/c1-6-20-26(24,25)18-11-9-17(10-12-18)19(23)22(15-16(4)5)14-13-21(7-2)8-3/h9-12,16,20H,6-8,13-15H2,1-5H3
InChIKeyITWNNNGJNUIZTQ-UHFFFAOYSA-N
MW383.56 g/mol
LogP2.42
Rot. Bonds11

About N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide

N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide (PubChem CID 55836803) has the molecular formula C19H33N3O3S and a molecular weight of 383.56 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide
PubChem CID55836803
Molecular FormulaC19H33N3O3S
Molecular Weight383.56 g/mol
Exact Mass383.22
IUPAC NameN-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)N(CCN(CC)CC)CC(C)C)cc1
InChIInChI=1S/C19H33N3O3S/c1-6-20-26(24,25)18-11-9-17(10-12-18)19(23)22(15-16(4)5)14-13-21(7-2)8-3/h9-12,16,20H,6-8,13-15H2,1-5H3
InChIKeyITWNNNGJNUIZTQ-UHFFFAOYSA-N
XLogP2.42
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.56
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)benzamide
CID 26532746
4-[[(2S)-2-(diethylamino)propyl]sulfamoyl]-N,N-diethylbenzamide
CID 95341841
N-[2-(diethylamino)propyl]-4-(ethylsulfamoyl)benzamide
CID 46432829
2-[[4-(butan-2-ylsulfamoyl)benzoyl]-(2-methylpropyl)amino]acetic acid
CID 119192606
4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide
CID 20854207
4-(2-aminoethylsulfamoyl)-N,N-diethylbenzamide;hydrochloride
CID 119960282
4-(ethylsulfamoyl)-N-(5-methylhexan-2-yl)benzamide
CID 86917372
1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide
CID 3616296
N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-1-oxidopyridin-1-ium-2-carboxamide
CID 60559149
[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl] 4-(ethylsulfamoyl)benzoate
CID 29459101
N-benzyl-N-butan-2-yl-4-(ethylsulfamoyl)benzamide
CID 56536430
N,N-diethyl-4-(methoxysulfamoyl)benzamide
CID 47051185

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide (CID 55836803) is N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide is CCNS(=O)(=O)c1ccc(C(=O)N(CCN(CC)CC)CC(C)C)cc1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide?
The InChIKey is ITWNNNGJNUIZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O3S/c1-6-20-26(24,25)18-11-9-17(10-12-18)19(23)22(15-16(4)5)14-13-21(7-2)8-3/h9-12,16,20H,6-8,13-15H2,1-5H3.
What are the key properties of N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide?
N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide has a molecular weight of 383.56 g/mol, XLogP of 2.42, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-4-(ethylsulfamoyl)-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 55836803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).