N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide

C15H25N3O3S — CID 113056474

IUPACN-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide
SMILESCC(=O)N(CCCc1ccccc1)CCNS(=O)(=O)N(C)C
InChIInChI=1S/C15H25N3O3S/c1-14(19)18(13-11-16-22(20,21)17(2)3)12-7-10-15-8-5-4-6-9-15/h4-6,8-9,16H,7,10-13H2,1-3H3
InChIKeyPTZKRTNYWSYHCA-UHFFFAOYSA-N
MW327.45 g/mol
LogP0.86
Rot. Bonds9

About N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide

N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide (PubChem CID 113056474) has the molecular formula C15H25N3O3S and a molecular weight of 327.45 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide
PubChem CID113056474
Molecular FormulaC15H25N3O3S
Molecular Weight327.45 g/mol
Exact Mass327.16
IUPAC NameN-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide
SMILESCC(=O)N(CCCc1ccccc1)CCNS(=O)(=O)N(C)C
InChIInChI=1S/C15H25N3O3S/c1-14(19)18(13-11-16-22(20,21)17(2)3)12-7-10-15-8-5-4-6-9-15/h4-6,8-9,16H,7,10-13H2,1-3H3
InChIKeyPTZKRTNYWSYHCA-UHFFFAOYSA-N
XLogP0.86
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylsulfamoylamino)ethyl]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113055867
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-propylacetamide
CID 113051944
N-benzyl-N-[2-(3-phenylpropylsulfonylamino)ethyl]acetamide
CID 113054093
N-[2-(dimethylsulfamoylamino)ethyl]-N-(2-phenylethyl)methanesulfonamide
CID 113067541
N-[2-[(2-chlorophenyl)sulfonylamino]ethyl]-N-(2-phenylethyl)acetamide
CID 113055627
N-[2-(dimethylsulfamoylamino)ethyl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 113054972
N-[2-(dimethylsulfamoylamino)ethyl]-N-(2-methoxyethyl)acetamide
CID 113053211
3-[acetyl(3-phenylpropyl)amino]-N-methyl-N-phenylpropanamide
CID 113122262
N-[2-(benzenesulfonamido)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide
CID 113056293
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-prop-2-enylacetamide
CID 113052352
N-[2-[acetyl(3-phenylpropyl)amino]ethyl]-2,3,4-trifluorobenzamide
CID 113056455
1-[3-(dimethylsulfamoylamino)propyl]-3-hydroxybenzene
CID 110667288

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide?
The IUPAC name of N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide (CID 113056474) is N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide.
What is the SMILES notation for N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide?
The canonical SMILES for N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide is CC(=O)N(CCCc1ccccc1)CCNS(=O)(=O)N(C)C.
What is the InChIKey of N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide?
The InChIKey is PTZKRTNYWSYHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3S/c1-14(19)18(13-11-16-22(20,21)17(2)3)12-7-10-15-8-5-4-6-9-15/h4-6,8-9,16H,7,10-13H2,1-3H3.
What are the key properties of N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide?
N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide has a molecular weight of 327.45 g/mol, XLogP of 0.86, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylsulfamoylamino)ethyl]-N-(3-phenylpropyl)acetamide is sourced from PubChem (CID 113056474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).