2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide

C13H20N2O3S — CID 43246558

IUPAC2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide
SMILESCCC(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1C
InChIInChI=1S/C13H20N2O3S/c1-4-10(5-2)13(16)15-12-7-6-11(8-9(12)3)19(14,17)18/h6-8,10H,4-5H2,1-3H3,(H,15,16)(H2,14,17,18)
InChIKeyGFLVAVVUJOISGN-UHFFFAOYSA-N
MW284.38 g/mol
LogP2.02
Rot. Bonds5

About 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide

2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide (PubChem CID 43246558) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide.

Molecular Properties

Compound Name2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide
PubChem CID43246558
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide
SMILESCCC(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1C
InChIInChI=1S/C13H20N2O3S/c1-4-10(5-2)13(16)15-12-7-6-11(8-9(12)3)19(14,17)18/h6-8,10H,4-5H2,1-3H3,(H,15,16)(H2,14,17,18)
InChIKeyGFLVAVVUJOISGN-UHFFFAOYSA-N
XLogP2.02
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-ethylbutanoylamino)-3-methylbenzenesulfonic acid
CID 72947233
N-(2,6-dimethyl-4-sulfamoylphenyl)-2-ethylbutanamide
CID 43246820
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
N-(2-chloro-4-sulfamoylphenyl)-2-ethylhexanamide
CID 43246745
2-ethyl-N-(2-ethyl-6-methyl-4-sulfamoylphenyl)butanamide
CID 43133984
N-(4-chloro-2-methylphenyl)-2-ethylbutanamide
CID 882107
(2S)-2-amino-3-methyl-N-(2-methyl-5-sulfamoylphenyl)pentanamide
CID 61172312
3-chloro-2-methyl-N-(2-methyl-5-sulfamoylphenyl)propanamide
CID 62727205
2-tert-butylsulfanyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 61132847
2-ethyl-N-(2-hydroxy-4-methylphenyl)butanamide
CID 1234613
2-cyclobutyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 103164399
N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide
CID 79155124

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide?
The IUPAC name of 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide (CID 43246558) is 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide.
What is the SMILES notation for 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide?
The canonical SMILES for 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide is CCC(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1C.
What is the InChIKey of 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide?
The InChIKey is GFLVAVVUJOISGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-4-10(5-2)13(16)15-12-7-6-11(8-9(12)3)19(14,17)18/h6-8,10H,4-5H2,1-3H3,(H,15,16)(H2,14,17,18).
What are the key properties of 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide?
2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide has a molecular weight of 284.38 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide is sourced from PubChem (CID 43246558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).