N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide

C15H23ClN2O3S — CID 2478774

IUPACN-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide
SMILESCC[C@@H](C)NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl
InChIInChI=1S/C15H23ClN2O3S/c1-5-11(4)17-15(19)13-10-12(8-9-14(13)16)22(20,21)18(6-2)7-3/h8-11H,5-7H2,1-4H3,(H,17,19)/t11-/m1/s1
InChIKeyLMTNZBSDNKNJAJ-LLVKDONJSA-N
MW346.88 g/mol
LogP2.90
Rot. Bonds7

About N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide

N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide (PubChem CID 2478774) has the molecular formula C15H23ClN2O3S and a molecular weight of 346.88 g/mol. Its IUPAC name is N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide
PubChem CID2478774
Molecular FormulaC15H23ClN2O3S
Molecular Weight346.88 g/mol
Exact Mass346.11
IUPAC NameN-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide
SMILESCC[C@@H](C)NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl
InChIInChI=1S/C15H23ClN2O3S/c1-5-11(4)17-15(19)13-10-12(8-9-14(13)16)22(20,21)18(6-2)7-3/h8-11H,5-7H2,1-4H3,(H,17,19)/t11-/m1/s1
InChIKeyLMTNZBSDNKNJAJ-LLVKDONJSA-N
XLogP2.90
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.88
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-5-(diethylsulfamoyl)-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 55364133
2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 51187743
2-chloro-5-(diethylsulfamoyl)-N-(3-methylbutyl)benzamide
CID 2677242
N-butan-2-yl-2-[(4-chlorophenyl)sulfonyl-ethylamino]acetamide
CID 4301159
N-tert-butyl-2-chloro-5-(diethylsulfamoyl)benzamide
CID 2404438
2-chloro-5-(diethylsulfamoyl)benzoate
CID 4206054
N-[2-[(2S)-butan-2-yl]phenyl]-2-chloro-5-(diethylsulfamoyl)benzamide
CID 2670785
N-butan-2-yl-2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzamide
CID 51160726
N-[(2R)-butan-2-yl]-2-chloro-5-nitrobenzamide
CID 40537964
2-chloro-5-(diethylsulfamoyl)-N-[(1R,2R)-1-pyrrolidin-1-yl-1-thiophen-2-ylpropan-2-yl]benzamide
CID 2374684
2-chloro-5-[2,2-dichloroethyl(ethyl)sulfamoyl]benzoic acid
CID 70536672
5-bromo-N-butan-2-yl-2-chlorobenzamide
CID 60629191

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide?
The IUPAC name of N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide (CID 2478774) is N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide.
What is the SMILES notation for N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide?
The canonical SMILES for N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide is CC[C@@H](C)NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl.
What is the InChIKey of N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide?
The InChIKey is LMTNZBSDNKNJAJ-LLVKDONJSA-N. The full InChI is InChI=1S/C15H23ClN2O3S/c1-5-11(4)17-15(19)13-10-12(8-9-14(13)16)22(20,21)18(6-2)7-3/h8-11H,5-7H2,1-4H3,(H,17,19)/t11-/m1/s1.
What are the key properties of N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide?
N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide has a molecular weight of 346.88 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide is sourced from PubChem (CID 2478774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).