N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide

C19H23FN2O3S — CID 113054620

IUPACN-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
SMILESCC(=O)N(CCNS(=O)(=O)CCc1ccccc1)Cc1ccccc1F
InChIInChI=1S/C19H23FN2O3S/c1-16(23)22(15-18-9-5-6-10-19(18)20)13-12-21-26(24,25)14-11-17-7-3-2-4-8-17/h2-10,21H,11-15H2,1H3
InChIKeyWXDJTXJPJZORNF-UHFFFAOYSA-N
MW378.47 g/mol
LogP2.34
Rot. Bonds9

About N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide

N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide (PubChem CID 113054620) has the molecular formula C19H23FN2O3S and a molecular weight of 378.47 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
PubChem CID113054620
Molecular FormulaC19H23FN2O3S
Molecular Weight378.47 g/mol
Exact Mass378.14
IUPAC NameN-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
SMILESCC(=O)N(CCNS(=O)(=O)CCc1ccccc1)Cc1ccccc1F
InChIInChI=1S/C19H23FN2O3S/c1-16(23)22(15-18-9-5-6-10-19(18)20)13-12-21-26(24,25)14-11-17-7-3-2-4-8-17/h2-10,21H,11-15H2,1H3
InChIKeyWXDJTXJPJZORNF-UHFFFAOYSA-N
XLogP2.34
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-phenylethylsulfonylamino)ethyl]-N-propylacetamide
CID 113051944
N-benzyl-N-[2-(3-phenylpropylsulfonylamino)ethyl]acetamide
CID 113054093
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-prop-2-enylacetamide
CID 113052352
3-[acetyl-[(2-fluorophenyl)methyl]amino]propanoic acid
CID 82044377
N-[(2-fluorophenyl)methyl]-N-[2-[(3-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113054618
N-(2,6-dimethylphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113058169
N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113060725
N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]ethyl]-N-[(2-fluorophenyl)methyl]acetamide
CID 113054619
N-[2-(dimethylamino)ethyl]-N-[(2-fluorophenyl)methyl]acetamide
CID 60559227
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-(2-propan-2-ylphenyl)acetamide
CID 113058668
N-[2-(butylsulfonylamino)ethyl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 113054971
2-[acetyl-[(2-fluorophenyl)methyl]amino]-N-benzyl-N-propan-2-ylacetamide
CID 113162207

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide (CID 113054620) is N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide is CC(=O)N(CCNS(=O)(=O)CCc1ccccc1)Cc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
The InChIKey is WXDJTXJPJZORNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3S/c1-16(23)22(15-18-9-5-6-10-19(18)20)13-12-21-26(24,25)14-11-17-7-3-2-4-8-17/h2-10,21H,11-15H2,1H3.
What are the key properties of N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide has a molecular weight of 378.47 g/mol, XLogP of 2.34, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide is sourced from PubChem (CID 113054620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).