N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide

C14H22N2O4S — CID 4530095

IUPACN-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1ccc(S(=O)(=O)NC(C)CC)cc1
InChIInChI=1S/C14H22N2O4S/c1-4-11(3)16-21(18,19)13-8-6-12(7-9-13)15-14(17)10-20-5-2/h6-9,11,16H,4-5,10H2,1-3H3,(H,15,17)
InChIKeyWOWLJELGNVPKHO-UHFFFAOYSA-N
MW314.41 g/mol
LogP1.74
Rot. Bonds8

About N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide

N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide (PubChem CID 4530095) has the molecular formula C14H22N2O4S and a molecular weight of 314.41 g/mol. Its IUPAC name is N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide.

Molecular Properties

Compound NameN-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide
PubChem CID4530095
Molecular FormulaC14H22N2O4S
Molecular Weight314.41 g/mol
Exact Mass314.13
IUPAC NameN-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1ccc(S(=O)(=O)NC(C)CC)cc1
InChIInChI=1S/C14H22N2O4S/c1-4-11(3)16-21(18,19)13-8-6-12(7-9-13)15-14(17)10-20-5-2/h6-9,11,16H,4-5,10H2,1-3H3,(H,15,17)
InChIKeyWOWLJELGNVPKHO-UHFFFAOYSA-N
XLogP1.74
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.41
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]butanamide
CID 51566560
N-[4-(butan-2-ylsulfamoyl)phenyl]acetamide
CID 3113473
2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(4-sulfamoylphenyl)acetamide
CID 126212081
N-(4-bromophenyl)-2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]acetamide
CID 1287541
N-[4-(butan-2-ylsulfamoyl)phenyl]-4-(propanoylamino)benzamide
CID 4209013
N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-3-phenylpropanamide
CID 1304672
N-[4-(butan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide
CID 2947595
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
CID 43877406
N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide
CID 51686284
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide
CID 17160244
1-[4-(butan-2-ylsulfamoyl)phenyl]-3-(4-chlorophenyl)urea
CID 17160150
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(4-methoxyphenoxy)propanamide
CID 17160189

Frequently Asked Questions

What is the IUPAC name of N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide?
The IUPAC name of N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide (CID 4530095) is N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide.
What is the SMILES notation for N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide?
The canonical SMILES for N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide is CCOCC(=O)Nc1ccc(S(=O)(=O)NC(C)CC)cc1.
What is the InChIKey of N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide?
The InChIKey is WOWLJELGNVPKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4S/c1-4-11(3)16-21(18,19)13-8-6-12(7-9-13)15-14(17)10-20-5-2/h6-9,11,16H,4-5,10H2,1-3H3,(H,15,17).
What are the key properties of N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide?
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide has a molecular weight of 314.41 g/mol, XLogP of 1.74, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide is sourced from PubChem (CID 4530095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).