N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide

C19H24N2O3S — CID 86922586

IUPACN-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide
SMILESCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C19H24N2O3S/c1-19(2,3)20-18(22)14-21(4)25(23,24)17-13-9-8-12-16(17)15-10-6-5-7-11-15/h5-13H,14H2,1-4H3,(H,20,22)
InChIKeyYJYXKEKBSKQMTF-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.89
Rot. Bonds5

About N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide

N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide (PubChem CID 86922586) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide
PubChem CID86922586
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide
SMILESCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C19H24N2O3S/c1-19(2,3)20-18(22)14-21(4)25(23,24)17-13-9-8-12-16(17)15-10-6-5-7-11-15/h5-13H,14H2,1-4H3,(H,20,22)
InChIKeyYJYXKEKBSKQMTF-UHFFFAOYSA-N
XLogP2.89
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-[methyl-[2-(trifluoromethyl)phenyl]sulfonylamino]acetamide
CID 78766636
N-tert-butyl-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 4190570
N,N-dimethyl-2-phenylbenzenesulfonamide
CID 19014102
N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 3963871
2-[(5-amino-2-bromophenyl)sulfonyl-methylamino]-N-tert-butylacetamide
CID 65207012
N-tert-butyl-2-[methyl-(4-nitrophenyl)sulfonylamino]acetamide
CID 9189054
N-tert-butyl-2-(N-methylsulfonylanilino)acetamide
CID 51343017
N-tert-butyl-2-[methyl-[(6-oxo-1H-pyridin-3-yl)sulfonyl]amino]acetamide
CID 60960044
N-tert-butyl-2-[methyl-[4-(trifluoromethoxy)phenyl]sulfonylamino]acetamide
CID 9189126
2-[(3-amino-4-methylphenyl)sulfonyl-methylamino]-N-tert-butylacetamide
CID 61125788
N-(1-amino-2,3-dimethylbutan-2-yl)-2-[benzenesulfonyl(methyl)amino]acetamide
CID 119605589
2-[(3-bromo-4-chlorophenyl)sulfonyl-methylamino]-N-tert-butylacetamide
CID 106545297

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide (CID 86922586) is N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide is CN(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide?
The InChIKey is YJYXKEKBSKQMTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-19(2,3)20-18(22)14-21(4)25(23,24)17-13-9-8-12-16(17)15-10-6-5-7-11-15/h5-13H,14H2,1-4H3,(H,20,22).
What are the key properties of N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide?
N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide has a molecular weight of 360.48 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[methyl-(2-phenylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 86922586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).