1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide

C9H10Cl2FNO2S — CID 59623734

IUPAC1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccc(Cl)cc1Cl)NCCF
InChIInChI=1S/C9H10Cl2FNO2S/c10-8-2-1-7(9(11)5-8)6-16(14,15)13-4-3-12/h1-2,5,13H,3-4,6H2
InChIKeyLLZVNLBOJWFQAB-UHFFFAOYSA-N
MW286.16 g/mol
LogP2.38
Rot. Bonds5

About 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide

1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide (PubChem CID 59623734) has the molecular formula C9H10Cl2FNO2S and a molecular weight of 286.16 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide
PubChem CID59623734
Molecular FormulaC9H10Cl2FNO2S
Molecular Weight286.16 g/mol
Exact Mass284.98
IUPAC Name1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccc(Cl)cc1Cl)NCCF
InChIInChI=1S/C9H10Cl2FNO2S/c10-8-2-1-7(9(11)5-8)6-16(14,15)13-4-3-12/h1-2,5,13H,3-4,6H2
InChIKeyLLZVNLBOJWFQAB-UHFFFAOYSA-N
XLogP2.38
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.16
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chloro-2-cyanophenyl)-N-[(2,4-dichlorophenyl)methyl]methanesulfonamide
CID 75447876
N-[(2,4-dichlorophenyl)methyl]-3-fluoropropan-1-amine
CID 115733095
2-[(2,4-dichlorophenyl)methylsulfonyl]ethanol
CID 82181727
1-(2,4-dichlorophenyl)-N-[(1S)-1-phenylpropyl]methanesulfonamide
CID 38009978
N-[(2,4-dichlorophenyl)methyl]butane-1-sulfonamide
CID 19680731
2,4-dichloro-1-[(chloroamino)sulfanylmethyl]benzene
CID 142470358
1-(2,4-dichlorophenyl)-N-(4-piperidin-1-ylphenyl)methanesulfonamide
CID 100512787
N-[2-[(2,4-dichlorophenyl)methoxy]ethyl]methanesulfonamide
CID 75445405
1-(2,4-dichlorophenyl)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]methanesulfonamide
CID 92674136
3,4-dichloro-N-(2-fluoroethyl)benzenesulfonamide
CID 87814655
N-[4-[2-(2,4-dichlorophenyl)ethylamino]phenyl]propane-1-sulfonamide
CID 112985739
1-(2,4-dichlorophenyl)-N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]methanesulfonamide
CID 92672393

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide?
The IUPAC name of 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide (CID 59623734) is 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide?
The canonical SMILES for 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide is O=S(=O)(Cc1ccc(Cl)cc1Cl)NCCF.
What is the InChIKey of 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide?
The InChIKey is LLZVNLBOJWFQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2FNO2S/c10-8-2-1-7(9(11)5-8)6-16(14,15)13-4-3-12/h1-2,5,13H,3-4,6H2.
What are the key properties of 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide?
1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide has a molecular weight of 286.16 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-N-(2-fluoroethyl)methanesulfonamide is sourced from PubChem (CID 59623734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).