N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide

C15H24N2O4S — CID 113061132

IUPACN-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCCS(=O)(=O)NCCN(C(C)=O)c1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O4S/c1-5-22(19,20)16-10-11-17(13(4)18)14-6-8-15(9-7-14)21-12(2)3/h6-9,12,16H,5,10-11H2,1-4H3
InChIKeyZDSUVYPKGYMNRR-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.77
Rot. Bonds8

About N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide

N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide (PubChem CID 113061132) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide
PubChem CID113061132
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC NameN-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCCS(=O)(=O)NCCN(C(C)=O)c1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O4S/c1-5-22(19,20)16-10-11-17(13(4)18)14-6-8-15(9-7-14)21-12(2)3/h6-9,12,16H,5,10-11H2,1-4H3
InChIKeyZDSUVYPKGYMNRR-UHFFFAOYSA-N
XLogP1.77
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(N-acetyl-4-propan-2-yloxyanilino)ethyl]benzamide
CID 113061087
N-[2-(N-acetyl-4-propan-2-yloxyanilino)ethyl]cyclobutanecarboxamide
CID 113061127
3-(N-acetyl-4-propan-2-yloxyanilino)-N-(3-methylbutyl)propanamide
CID 113129869
N-(3-chloro-4-methoxyphenyl)-N-[2-(ethylsulfonylamino)ethyl]acetamide
CID 113060257
N-[2-(ethylsulfonylamino)ethyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 113062527
N-[2-(N-acetyl-4-propan-2-yloxyanilino)ethyl]furan-2-carboxamide
CID 113061085
N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113060725
N-[2-(N-acetyl-4-propan-2-yloxyanilino)ethyl]-3,4-difluorobenzamide
CID 113061115
2-(N-acetyl-4-propan-2-yloxyanilino)-N-butan-2-ylacetamide
CID 113174353
N-(4-bromo-3-methylphenyl)-N-[2-(propylsulfonylamino)ethyl]acetamide
CID 113062931
N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
CID 113060704
N-(2,6-diethylphenyl)-N-[2-(ethylsulfonylamino)ethyl]acetamide
CID 113058917

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide?
The IUPAC name of N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide (CID 113061132) is N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide is CCS(=O)(=O)NCCN(C(C)=O)c1ccc(OC(C)C)cc1.
What is the InChIKey of N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide?
The InChIKey is ZDSUVYPKGYMNRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-5-22(19,20)16-10-11-17(13(4)18)14-6-8-15(9-7-14)21-12(2)3/h6-9,12,16H,5,10-11H2,1-4H3.
What are the key properties of N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide?
N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide has a molecular weight of 328.43 g/mol, XLogP of 1.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 113061132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).