2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide

C14H13F3N2O3S2 — CID 6621493

IUPAC2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCN(CC(=O)Nc1ccc(C(F)(F)F)cc1)S(=O)(=O)c1cccs1
InChIInChI=1S/C14H13F3N2O3S2/c1-19(24(21,22)13-3-2-8-23-13)9-12(20)18-11-6-4-10(5-7-11)14(15,16)17/h2-8H,9H2,1H3,(H,18,20)
InChIKeyFDCKGPDCVBWICK-UHFFFAOYSA-N
MW378.40 g/mol
LogP3.03
Rot. Bonds5

About 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide

2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 6621493) has the molecular formula C14H13F3N2O3S2 and a molecular weight of 378.40 g/mol. Its IUPAC name is 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID6621493
Molecular FormulaC14H13F3N2O3S2
Molecular Weight378.40 g/mol
Exact Mass378.03
IUPAC Name2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCN(CC(=O)Nc1ccc(C(F)(F)F)cc1)S(=O)(=O)c1cccs1
InChIInChI=1S/C14H13F3N2O3S2/c1-19(24(21,22)13-3-2-8-23-13)9-12(20)18-11-6-4-10(5-7-11)14(15,16)17/h2-8H,9H2,1H3,(H,18,20)
InChIKeyFDCKGPDCVBWICK-UHFFFAOYSA-N
XLogP3.03
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.40
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide (CID 6621493) is 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide is CN(CC(=O)Nc1ccc(C(F)(F)F)cc1)S(=O)(=O)c1cccs1.
What is the InChIKey of 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is FDCKGPDCVBWICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O3S2/c1-19(24(21,22)13-3-2-8-23-13)9-12(20)18-11-6-4-10(5-7-11)14(15,16)17/h2-8H,9H2,1H3,(H,18,20).
What are the key properties of 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide?
2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 378.40 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 6621493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).