N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide

C20H26N2O3S — CID 113154140

IUPACN-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
SMILESCCc1ccccc1N(CC(=O)N(CC)c1cccc(C)c1)S(C)(=O)=O
InChIInChI=1S/C20H26N2O3S/c1-5-17-11-7-8-13-19(17)22(26(4,24)25)15-20(23)21(6-2)18-12-9-10-16(3)14-18/h7-14H,5-6,15H2,1-4H3
InChIKeyKSQRKIBJGMOQPV-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.38
Rot. Bonds7

About N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide

N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide (PubChem CID 113154140) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
PubChem CID113154140
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
SMILESCCc1ccccc1N(CC(=O)N(CC)c1cccc(C)c1)S(C)(=O)=O
InChIInChI=1S/C20H26N2O3S/c1-5-17-11-7-8-13-19(17)22(26(4,24)25)15-20(23)21(6-2)18-12-9-10-16(3)14-18/h7-14H,5-6,15H2,1-4H3
InChIKeyKSQRKIBJGMOQPV-UHFFFAOYSA-N
XLogP3.38
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(2-methoxy-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
CID 113155154
N-ethyl-N-(3-methylphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 113153695
2-(3-chloro-2-methyl-N-methylsulfonylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113154894
N-ethyl-N-(3-methylphenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 113154382
N-ethyl-2-(2-methoxy-5-methyl-N-methylsulfonylanilino)-N-phenylacetamide
CID 113155307
N-ethyl-N-(3-methylphenyl)-2-[methylsulfonyl(2-phenylethyl)amino]acetamide
CID 113151893
3-(N-ethyl-3-methylanilino)-3-oxopropane-1-sulfonyl chloride
CID 98489365
N-ethyl-N-(3-methylphenyl)-2-[methylsulfonyl(1-phenylethyl)amino]acetamide
CID 113150932
ethyl 4-(N-ethyl-3-methylanilino)-4-oxobutanoate
CID 60737731
2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113167645
N-ethyl-N-(3-methylphenyl)-3-[(2-methylphenyl)methyl-methylsulfonylamino]propanamide
CID 113138845
3-(2,4-difluoro-N-methylsulfonylanilino)-N-ethyl-N-(3-methylphenyl)propanamide
CID 113146418

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide?
The IUPAC name of N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide (CID 113154140) is N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide?
The canonical SMILES for N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide is CCc1ccccc1N(CC(=O)N(CC)c1cccc(C)c1)S(C)(=O)=O.
What is the InChIKey of N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide?
The InChIKey is KSQRKIBJGMOQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-5-17-11-7-8-13-19(17)22(26(4,24)25)15-20(23)21(6-2)18-12-9-10-16(3)14-18/h7-14H,5-6,15H2,1-4H3.
What are the key properties of N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide?
N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide has a molecular weight of 374.51 g/mol, XLogP of 3.38, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-ethyl-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 113154140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).