N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide

C15H24N2O4S — CID 51331716

IUPACN-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide
SMILESCCC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)COC)cc1
InChIInChI=1S/C15H24N2O4S/c1-5-11(2)15(18)16-13-6-8-14(9-7-13)22(19,20)17-12(3)10-21-4/h6-9,11-12,17H,5,10H2,1-4H3,(H,16,18)
InChIKeyGMAURLBNVYPTCN-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.98
Rot. Bonds8

About N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide

N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide (PubChem CID 51331716) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide.

Molecular Properties

Compound NameN-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide
PubChem CID51331716
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC NameN-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide
SMILESCCC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)COC)cc1
InChIInChI=1S/C15H24N2O4S/c1-5-11(2)15(18)16-13-6-8-14(9-7-13)22(19,20)17-12(3)10-21-4/h6-9,11-12,17H,5,10H2,1-4H3,(H,16,18)
InChIKeyGMAURLBNVYPTCN-UHFFFAOYSA-N
XLogP1.98
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
CID 670303
4-(1-methoxypropan-2-ylsulfamoyl)-N-(4-sulfamoylphenyl)benzamide
CID 42909880
4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide
CID 9294142
N-[4-(butan-2-ylsulfamoyl)phenyl]acetamide
CID 3113473
2,6-difluoro-N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]benzamide
CID 78778266
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-phenylbutanamide
CID 43007936
4-ethyl-N-(1-methoxypropan-2-yl)benzenesulfonamide
CID 51183649
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]pyridine-2-carboxamide
CID 4780813
2-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 51331498
4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzenesulfonamide
CID 884361
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide
CID 47004794
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-4-phenoxybutanamide
CID 43007962

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide?
The IUPAC name of N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide (CID 51331716) is N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide.
What is the SMILES notation for N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide?
The canonical SMILES for N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide is CCC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)COC)cc1.
What is the InChIKey of N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide?
The InChIKey is GMAURLBNVYPTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-5-11(2)15(18)16-13-6-8-14(9-7-13)22(19,20)17-12(3)10-21-4/h6-9,11-12,17H,5,10H2,1-4H3,(H,16,18).
What are the key properties of N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide?
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide has a molecular weight of 328.43 g/mol, XLogP of 1.98, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide is sourced from PubChem (CID 51331716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).