N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide

C19H24N2O4S — CID 55573376

IUPACN-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide
SMILESCCC(C)c1ccc(S(=O)(=O)Nc2ccc(NC(=O)COC)cc2)cc1
InChIInChI=1S/C19H24N2O4S/c1-4-14(2)15-5-11-18(12-6-15)26(23,24)21-17-9-7-16(8-10-17)20-19(22)13-25-3/h5-12,14,21H,4,13H2,1-3H3,(H,20,22)
InChIKeyOGHFBEBUPWXEAL-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.59
Rot. Bonds8

About N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide

N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide (PubChem CID 55573376) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide
PubChem CID55573376
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide
SMILESCCC(C)c1ccc(S(=O)(=O)Nc2ccc(NC(=O)COC)cc2)cc1
InChIInChI=1S/C19H24N2O4S/c1-4-14(2)15-5-11-18(12-6-15)26(23,24)21-17-9-7-16(8-10-17)20-19(22)13-25-3/h5-12,14,21H,4,13H2,1-3H3,(H,20,22)
InChIKeyOGHFBEBUPWXEAL-UHFFFAOYSA-N
XLogP3.59
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-butan-2-yl-N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 25042708
4-[[4-[(2-methoxyacetyl)amino]phenyl]sulfamoyl]benzamide
CID 30805411
4-butan-2-yl-N-[4-(methylsulfamoyl)phenyl]benzenesulfonamide
CID 17388091
2-[4-[(4-ethoxyphenyl)sulfamoyl]phenoxy]-N-(4-propan-2-ylphenyl)acetamide
CID 4238815
4-[(2S)-butan-2-yl]-N-(4-sulfamoylphenyl)benzenesulfonamide
CID 2524649
2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
CID 700857
1-(4-butan-2-ylphenyl)-3-[(2-methoxyacetyl)amino]thiourea
CID 17372708
[2-[4-[(2S)-butan-2-yl]anilino]-2-oxoethyl] 2-[(4-methylphenyl)sulfonylamino]acetate
CID 7839568
2-methoxy-N-[4-[1-(methylamino)ethyl]phenyl]acetamide
CID 61279184
2-methoxy-N-[4-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]phenyl]acetamide
CID 35541901
4-butan-2-yl-N-(3,4-dimethoxyphenyl)benzenesulfonamide
CID 22202165
[2-[4-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 4-(methoxymethyl)benzoate
CID 7488942

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide?
The IUPAC name of N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide (CID 55573376) is N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide is CCC(C)c1ccc(S(=O)(=O)Nc2ccc(NC(=O)COC)cc2)cc1.
What is the InChIKey of N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide?
The InChIKey is OGHFBEBUPWXEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-4-14(2)15-5-11-18(12-6-15)26(23,24)21-17-9-7-16(8-10-17)20-19(22)13-25-3/h5-12,14,21H,4,13H2,1-3H3,(H,20,22).
What are the key properties of N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide?
N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide has a molecular weight of 376.48 g/mol, XLogP of 3.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]-2-methoxyacetamide is sourced from PubChem (CID 55573376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).