N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide

C14H14F2N2O3S2 — CID 113064682

IUPACN-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
SMILESCC(=O)N(CCNS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1
InChIInChI=1S/C14H14F2N2O3S2/c1-10(19)18(11-4-5-12(15)13(16)9-11)7-6-17-23(20,21)14-3-2-8-22-14/h2-5,8-9,17H,6-7H2,1H3
InChIKeyXJPKFFHALDLGLP-UHFFFAOYSA-N
MW360.41 g/mol
LogP2.36
Rot. Bonds6

About N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide

N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide (PubChem CID 113064682) has the molecular formula C14H14F2N2O3S2 and a molecular weight of 360.41 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
PubChem CID113064682
Molecular FormulaC14H14F2N2O3S2
Molecular Weight360.41 g/mol
Exact Mass360.04
IUPAC NameN-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
SMILESCC(=O)N(CCNS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1
InChIInChI=1S/C14H14F2N2O3S2/c1-10(19)18(11-4-5-12(15)13(16)9-11)7-6-17-23(20,21)14-3-2-8-22-14/h2-5,8-9,17H,6-7H2,1H3
InChIKeyXJPKFFHALDLGLP-UHFFFAOYSA-N
XLogP2.36
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
CID 113061619
N-(4-ethylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
CID 113058478
N-[2-[(5-chlorothiophen-2-yl)sulfonylamino]ethyl]-N-(3,4-difluorophenyl)acetamide
CID 113064685
N-(4-cyanophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
CID 113064398
N-(3,4-difluorophenyl)-N-[2-(dimethylsulfamoylamino)ethyl]acetamide
CID 113064664
N-(3,4-difluorophenyl)-N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]acetamide
CID 113064672
N-(2-propan-2-ylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
CID 113058664
N-(2-chloro-4,6-dimethylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
CID 113060196
N-[2-(benzenesulfonamido)ethyl]-N-(3-chloro-4-fluorophenyl)acetamide
CID 113060118
N-[2-(dimethylamino)ethyl]-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
CID 113053614
3-(N-acetyl-3,4-difluoroanilino)propanoic acid
CID 28764847
N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(3-fluorophenyl)acetamide
CID 113062699

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide (CID 113064682) is N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide is CC(=O)N(CCNS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
The InChIKey is XJPKFFHALDLGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O3S2/c1-10(19)18(11-4-5-12(15)13(16)9-11)7-6-17-23(20,21)14-3-2-8-22-14/h2-5,8-9,17H,6-7H2,1H3.
What are the key properties of N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide has a molecular weight of 360.41 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide is sourced from PubChem (CID 113064682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).