N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide

C20H24N2O4S — CID 113094790

IUPACN-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide
SMILESCS(=O)(=O)Nc1ccc(N(C(=O)Cc2ccccc2)C2CCOCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-27(24,25)21-17-7-9-18(10-8-17)22(19-11-13-26-14-12-19)20(23)15-16-5-3-2-4-6-16/h2-10,19,21H,11-15H2,1H3
InChIKeyNRDANLYVBWZSIU-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.81
Rot. Bonds6

About N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide

N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide (PubChem CID 113094790) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide
PubChem CID113094790
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC NameN-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide
SMILESCS(=O)(=O)Nc1ccc(N(C(=O)Cc2ccccc2)C2CCOCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-27(24,25)21-17-7-9-18(10-8-17)22(19-11-13-26-14-12-19)20(23)15-16-5-3-2-4-6-16/h2-10,19,21H,11-15H2,1H3
InChIKeyNRDANLYVBWZSIU-UHFFFAOYSA-N
XLogP2.81
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)propanamide
CID 113094770
N-(4-acetamidophenyl)-2-(3-methylphenyl)-N-(oxan-4-yl)acetamide
CID 113095232
N-[4-(benzenesulfonamido)phenyl]-N-(oxan-4-yl)acetamide
CID 113094220
N-[4-[(2-methylphenyl)sulfonylamino]phenyl]-N-(oxan-4-yl)acetamide
CID 113094228
3-[1-[[4-[4-(methanesulfonamido)phenoxy]phenyl]methyl]piperidin-4-yl]-1-(oxan-4-yl)-1-phenylurea
CID 142688676
1-[1-[[4-[4-(methanesulfonamido)phenoxy]phenyl]methyl]piperidin-4-yl]-3-(oxan-4-yl)-1-phenylurea
CID 66814164
N,2-diphenyl-N-(4-propan-2-ylcyclohexyl)acetamide
CID 21025612
N-(oxan-4-yl)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 113094206
N-[4-[oxan-4-yl(phenylcarbamoyl)amino]phenyl]acetamide
CID 113095234
N-cyclopropyl-N-[4-(methanesulfonamido)phenyl]oxolane-2-carboxamide
CID 113094693
N-benzyl-N-cyclopropyl-4-(methanesulfonamido)benzamide
CID 38253884
N-[4-(oxane-4-carbonyl)phenyl]methanesulfonamide
CID 62907557

Frequently Asked Questions

What is the IUPAC name of N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide?
The IUPAC name of N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide (CID 113094790) is N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide.
What is the SMILES notation for N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide?
The canonical SMILES for N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide is CS(=O)(=O)Nc1ccc(N(C(=O)Cc2ccccc2)C2CCOCC2)cc1.
What is the InChIKey of N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide?
The InChIKey is NRDANLYVBWZSIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-27(24,25)21-17-7-9-18(10-8-17)22(19-11-13-26-14-12-19)20(23)15-16-5-3-2-4-6-16/h2-10,19,21H,11-15H2,1H3.
What are the key properties of N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide?
N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide has a molecular weight of 388.49 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methanesulfonamido)phenyl]-N-(oxan-4-yl)-2-phenylacetamide is sourced from PubChem (CID 113094790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).