N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide

C17H19N3O5S — CID 9295740

IUPACN-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCC(N)=O)c2)cc1
InChIInChI=1S/C17H19N3O5S/c1-2-25-14-6-8-15(9-7-14)26(23,24)20-13-5-3-4-12(10-13)17(22)19-11-16(18)21/h3-10,20H,2,11H2,1H3,(H2,18,21)(H,19,22)
InChIKeyGCJHQUBMEUKWGW-UHFFFAOYSA-N
MW377.42 g/mol
LogP1.10
Rot. Bonds8

About N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide

N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide (PubChem CID 9295740) has the molecular formula C17H19N3O5S and a molecular weight of 377.42 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
PubChem CID9295740
Molecular FormulaC17H19N3O5S
Molecular Weight377.42 g/mol
Exact Mass377.10
IUPAC NameN-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCC(N)=O)c2)cc1
InChIInChI=1S/C17H19N3O5S/c1-2-25-14-6-8-15(9-7-14)26(23,24)20-13-5-3-4-12(10-13)17(22)19-11-16(18)21/h3-10,20H,2,11H2,1H3,(H2,18,21)(H,19,22)
InChIKeyGCJHQUBMEUKWGW-UHFFFAOYSA-N
XLogP1.10
TPSA127.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-2-oxoethyl)-3-[[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]sulfonylamino]benzamide
CID 55663136
3-[(4-ethoxyphenyl)sulfonylamino]-N-[3-(4-ethylpiperazin-1-yl)propyl]benzamide
CID 55660110
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 30860583
N-(2-anilino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 55958800
3-[(4-ethoxyphenyl)sulfonylamino]-N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 25472628
N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 43017221
N-[4-(3,5-dimethylpiperidin-1-yl)butyl]-3-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 55847760
N-[3-(azepane-1-carbonyl)phenyl]-4-ethoxybenzenesulfonamide
CID 7398605
3-[(3,4-difluorophenyl)sulfonylamino]-N-(4-ethoxyphenyl)benzamide
CID 5061186
4-ethoxy-N-[3-[[[2-(4-fluorophenyl)acetyl]amino]carbamoyl]phenyl]benzenesulfonamide
CID 26656829
3-[(4-ethoxyphenyl)sulfonylamino]-N-[(1S)-1-(furan-2-yl)ethyl]benzamide
CID 9305876
3-[(4-ethoxyphenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 26710792

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide (CID 9295740) is N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide is CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCC(N)=O)c2)cc1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide?
The InChIKey is GCJHQUBMEUKWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O5S/c1-2-25-14-6-8-15(9-7-14)26(23,24)20-13-5-3-4-12(10-13)17(22)19-11-16(18)21/h3-10,20H,2,11H2,1H3,(H2,18,21)(H,19,22).
What are the key properties of N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide?
N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide has a molecular weight of 377.42 g/mol, XLogP of 1.10, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-3-[(4-ethoxyphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 9295740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).