N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide

C10H15NO2S2 — CID 149210382

IUPACN-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide
SMILESCCN(c1ccc(SC)cc1)S(C)(=O)=O
InChIInChI=1S/C10H15NO2S2/c1-4-11(15(3,12)13)9-5-7-10(14-2)8-6-9/h5-8H,4H2,1-3H3
InChIKeyXGLQEVFWIZMXIN-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.19
Rot. Bonds4

About N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide

N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide (PubChem CID 149210382) has the molecular formula C10H15NO2S2 and a molecular weight of 245.37 g/mol. Its IUPAC name is N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide
PubChem CID149210382
Molecular FormulaC10H15NO2S2
Molecular Weight245.37 g/mol
Exact Mass245.05
IUPAC NameN-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide
SMILESCCN(c1ccc(SC)cc1)S(C)(=O)=O
InChIInChI=1S/C10H15NO2S2/c1-4-11(15(3,12)13)9-5-7-10(14-2)8-6-9/h5-8H,4H2,1-3H3
InChIKeyXGLQEVFWIZMXIN-UHFFFAOYSA-N
XLogP2.19
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-fluorophenyl)-N-ethylmethanesulfonamide
CID 39248117
N-(3-chloro-4-methylphenyl)-N-ethyl-4-methylsulfanylbenzenesulfonamide
CID 100517948
N-(2,6-diethylphenyl)-4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]benzamide
CID 28591623
N-(1,3-benzodioxol-5-yl)-N-ethyl-4-methylsulfanylbenzenesulfonamide
CID 100517507
N-[4-(azepane-1-carbonyl)phenyl]-N-ethyl-4-methylsulfanylbenzenesulfonamide
CID 28591584
ethyl 2-(4-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetate
CID 95050818
2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)acetate
CID 2271131
2-(4-methyl-N-methylsulfonylanilino)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]acetamide
CID 6876872
2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)-N,N-dimethylacetamide
CID 1334991
2-(4-iodo-N-methylsulfonylanilino)-N-[(Z)-(4-methylsulfanylphenyl)methylideneamino]acetamide
CID 126033644
N,N-bis[4-[dichloro(methyl)-λ4-sulfanyl]phenyl]-4-methylsulfanylaniline
CID 126496204
N-[[4-(diethylamino)phenyl]methyl]-4-methylsulfanylbenzenesulfonamide
CID 99933129

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide?
The IUPAC name of N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide (CID 149210382) is N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide.
What is the SMILES notation for N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide?
The canonical SMILES for N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide is CCN(c1ccc(SC)cc1)S(C)(=O)=O.
What is the InChIKey of N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide?
The InChIKey is XGLQEVFWIZMXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S2/c1-4-11(15(3,12)13)9-5-7-10(14-2)8-6-9/h5-8H,4H2,1-3H3.
What are the key properties of N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide?
N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide has a molecular weight of 245.37 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-methylsulfanylphenyl)methanesulfonamide is sourced from PubChem (CID 149210382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).