N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide

C15H15FN2O3S2 — CID 26055171

IUPACN-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
SMILESC=CCN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1cccs1
InChIInChI=1S/C15H15FN2O3S2/c1-2-9-18(23(20,21)15-4-3-10-22-15)11-14(19)17-13-7-5-12(16)6-8-13/h2-8,10H,1,9,11H2,(H,17,19)
InChIKeyQAQWIKLUOICQDF-UHFFFAOYSA-N
MW354.43 g/mol
LogP2.70
Rot. Bonds7

About N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide

N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide (PubChem CID 26055171) has the molecular formula C15H15FN2O3S2 and a molecular weight of 354.43 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
PubChem CID26055171
Molecular FormulaC15H15FN2O3S2
Molecular Weight354.43 g/mol
Exact Mass354.05
IUPAC NameN-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
SMILESC=CCN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1cccs1
InChIInChI=1S/C15H15FN2O3S2/c1-2-9-18(23(20,21)15-4-3-10-22-15)11-14(19)17-13-7-5-12(16)6-8-13/h2-8,10H,1,9,11H2,(H,17,19)
InChIKeyQAQWIKLUOICQDF-UHFFFAOYSA-N
XLogP2.70
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(1,3-benzodioxol-5-yl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 26055162
N-(4-iodo-2-methylphenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 26055182
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 31323268
2-[butyl(thiophen-2-ylsulfonyl)amino]-N-(4-phenoxyphenyl)acetamide
CID 2107882
N-(4-fluorophenyl)-2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetamide
CID 16547796
N-(4-tert-butylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 7685406
2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 55489697
methyl 2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]benzoate
CID 100548313
3-[[2-(4-fluoroanilino)-2-oxoethyl]-prop-2-enylamino]propanoic acid
CID 82326611
2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-N-(3-propan-2-yloxyphenyl)acetamide
CID 30275804
N-ethyl-N-naphthalen-1-yl-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 31472011
2-[(4-acetylphenyl)sulfonyl-prop-2-enylamino]-N-phenylacetamide
CID 17443852

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide (CID 26055171) is N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide is C=CCN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1cccs1.
What is the InChIKey of N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide?
The InChIKey is QAQWIKLUOICQDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3S2/c1-2-9-18(23(20,21)15-4-3-10-22-15)11-14(19)17-13-7-5-12(16)6-8-13/h2-8,10H,1,9,11H2,(H,17,19).
What are the key properties of N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide?
N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide has a molecular weight of 354.43 g/mol, XLogP of 2.70, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 26055171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).