N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide

C10H10F3NO2S — CID 2366624

IUPACN-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide
SMILESC=CCNS(=O)(=O)c1ccccc1C(F)(F)F
InChIInChI=1S/C10H10F3NO2S/c1-2-7-14-17(15,16)9-6-4-3-5-8(9)10(11,12)13/h2-6,14H,1,7H2
InChIKeyCLUMIBOQMDUSOJ-UHFFFAOYSA-N
MW265.26 g/mol
LogP2.17
Rot. Bonds4

About N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide

N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide (PubChem CID 2366624) has the molecular formula C10H10F3NO2S and a molecular weight of 265.26 g/mol. Its IUPAC name is N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide
PubChem CID2366624
Molecular FormulaC10H10F3NO2S
Molecular Weight265.26 g/mol
Exact Mass265.04
IUPAC NameN-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide
SMILESC=CCNS(=O)(=O)c1ccccc1C(F)(F)F
InChIInChI=1S/C10H10F3NO2S/c1-2-7-14-17(15,16)9-6-4-3-5-8(9)10(11,12)13/h2-6,14H,1,7H2
InChIKeyCLUMIBOQMDUSOJ-UHFFFAOYSA-N
XLogP2.17
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.26
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide (CID 2366624) is N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide is C=CCNS(=O)(=O)c1ccccc1C(F)(F)F.
What is the InChIKey of N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide?
The InChIKey is CLUMIBOQMDUSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2S/c1-2-7-14-17(15,16)9-6-4-3-5-8(9)10(11,12)13/h2-6,14H,1,7H2.
What are the key properties of N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide?
N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide has a molecular weight of 265.26 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-2-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 2366624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).