N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide

C20H26N2O3S — CID 1293342

IUPACN-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide
SMILESCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)CCCc2ccccc2)cc1
InChIInChI=1S/C20H26N2O3S/c1-20(2,3)22-26(24,25)18-14-12-17(13-15-18)21-19(23)11-7-10-16-8-5-4-6-9-16/h4-6,8-9,12-15,22H,7,10-11H2,1-3H3,(H,21,23)
InChIKeyUDZYYTVKMNOROQ-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.72
Rot. Bonds7

About N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide

N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide (PubChem CID 1293342) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide.

Molecular Properties

Compound NameN-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide
PubChem CID1293342
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide
SMILESCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)CCCc2ccccc2)cc1
InChIInChI=1S/C20H26N2O3S/c1-20(2,3)22-26(24,25)18-14-12-17(13-15-18)21-19(23)11-7-10-16-8-5-4-6-9-16/h4-6,8-9,12-15,22H,7,10-11H2,1-3H3,(H,21,23)
InChIKeyUDZYYTVKMNOROQ-UHFFFAOYSA-N
XLogP3.72
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis[4-(tert-butylsulfamoyl)phenyl]hexanediamide
CID 4992549
3-[4-(tert-butylsulfamoyl)phenyl]-N-(4-phenoxyphenyl)propanamide
CID 4044394
methyl 4-[4-(tert-butylsulfamoyl)anilino]-4-oxobutanoate
CID 5199846
N-[4-(4-oxopentyl)phenyl]-4-phenylbutanamide
CID 21335633
N-(4-butylphenyl)-4-phenylbutanamide
CID 7313944
N-[4-(tert-butylsulfamoyl)phenyl]-3,3-dimethylbutanamide
CID 3391312
N-[4-(2-phenylethylsulfamoyl)phenyl]heptanamide
CID 54790596
4-chloro-N-[4-(2-phenylethylsulfamoyl)phenyl]butanamide
CID 17160952
N-[4-(benzylsulfamoyl)phenyl]octanamide
CID 4958608
N-(3-acetylphenyl)-3-[4-(tert-butylsulfamoyl)phenyl]propanamide
CID 1296104
N-(3-bromophenyl)-3-[4-(tert-butylsulfamoyl)phenyl]propanamide
CID 126268267
N-[4-(benzylsulfamoyl)phenyl]-4-chlorobutanamide
CID 17160967

Frequently Asked Questions

What is the IUPAC name of N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide?
The IUPAC name of N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide (CID 1293342) is N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide.
What is the SMILES notation for N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide?
The canonical SMILES for N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide is CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)CCCc2ccccc2)cc1.
What is the InChIKey of N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide?
The InChIKey is UDZYYTVKMNOROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-20(2,3)22-26(24,25)18-14-12-17(13-15-18)21-19(23)11-7-10-16-8-5-4-6-9-16/h4-6,8-9,12-15,22H,7,10-11H2,1-3H3,(H,21,23).
What are the key properties of N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide?
N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide has a molecular weight of 374.51 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(tert-butylsulfamoyl)phenyl]-4-phenylbutanamide is sourced from PubChem (CID 1293342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).