2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide

C15H23ClN2O4S — CID 78855605

IUPAC2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide
SMILESCCN(CCO)C(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl
InChIInChI=1S/C15H23ClN2O4S/c1-5-18(8-9-19)15(20)13-10-12(6-7-14(13)16)23(21,22)17(4)11(2)3/h6-7,10-11,19H,5,8-9H2,1-4H3
InChIKeyRIZLFTBDCSKRDL-UHFFFAOYSA-N
MW362.88 g/mol
LogP1.82
Rot. Bonds7

About 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide

2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide (PubChem CID 78855605) has the molecular formula C15H23ClN2O4S and a molecular weight of 362.88 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide
PubChem CID78855605
Molecular FormulaC15H23ClN2O4S
Molecular Weight362.88 g/mol
Exact Mass362.11
IUPAC Name2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide
SMILESCCN(CCO)C(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl
InChIInChI=1S/C15H23ClN2O4S/c1-5-18(8-9-19)15(20)13-10-12(6-7-14(13)16)23(21,22)17(4)11(2)3/h6-7,10-11,19H,5,8-9H2,1-4H3
InChIKeyRIZLFTBDCSKRDL-UHFFFAOYSA-N
XLogP1.82
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.88
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 78855508
2-chloro-N-(3-hydroxypropyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 78854298
2-chloro-5-(dimethylsulfamoyl)-N-(2-hydroxyethyl)-N-(2-phenylethyl)benzamide
CID 86943587
2-chloro-N-methyl-5-[methyl(propan-2-yl)sulfamoyl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 56510508
N-butyl-N-(2-hydroxyethyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 78855791
N-butyl-2-chloro-N-ethyl-5-(methylsulfamoyl)benzamide
CID 51166063
2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-(3-methylbutanoylamino)benzamide
CID 109468086
2-chloro-N-[(1S)-3-hydroxy-1-phenylpropyl]-5-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 97017563
3-(azocane-1-carbonyl)-4-chloro-N-methyl-N-propan-2-ylbenzenesulfonamide
CID 51145580
ethyl 4-[2-chloro-5-[methyl(propan-2-yl)sulfamoyl]benzoyl]piperazine-1-carboxylate
CID 36861151
2-chloro-5-(dimethylsulfamoyl)-N,N-bis(2-phenylethyl)benzamide
CID 38071509
5-[bis(2-hydroxyethyl)sulfamoyl]-2-chlorobenzoate
CID 4577559

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide?
The IUPAC name of 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide (CID 78855605) is 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide.
What is the SMILES notation for 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide?
The canonical SMILES for 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide is CCN(CCO)C(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl.
What is the InChIKey of 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide?
The InChIKey is RIZLFTBDCSKRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O4S/c1-5-18(8-9-19)15(20)13-10-12(6-7-14(13)16)23(21,22)17(4)11(2)3/h6-7,10-11,19H,5,8-9H2,1-4H3.
What are the key properties of 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide?
2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide has a molecular weight of 362.88 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-(2-hydroxyethyl)-5-[methyl(propan-2-yl)sulfamoyl]benzamide is sourced from PubChem (CID 78855605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).