N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide

C15H20F2N2O3S — CID 113156765

IUPACN-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide
SMILESCS(=O)(=O)N(CC(=O)NC1CCCCC1)c1ccc(F)cc1F
InChIInChI=1S/C15H20F2N2O3S/c1-23(21,22)19(14-8-7-11(16)9-13(14)17)10-15(20)18-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,18,20)
InChIKeyDBWKIPHRTZHHJO-UHFFFAOYSA-N
MW346.40 g/mol
LogP2.18
Rot. Bonds5

About N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide

N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide (PubChem CID 113156765) has the molecular formula C15H20F2N2O3S and a molecular weight of 346.40 g/mol. Its IUPAC name is N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide
PubChem CID113156765
Molecular FormulaC15H20F2N2O3S
Molecular Weight346.40 g/mol
Exact Mass346.12
IUPAC NameN-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide
SMILESCS(=O)(=O)N(CC(=O)NC1CCCCC1)c1ccc(F)cc1F
InChIInChI=1S/C15H20F2N2O3S/c1-23(21,22)19(14-8-7-11(16)9-13(14)17)10-15(20)18-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,18,20)
InChIKeyDBWKIPHRTZHHJO-UHFFFAOYSA-N
XLogP2.18
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-(2,3,4-trifluoro-N-methylsulfonylanilino)acetamide
CID 113157484
N-cycloheptyl-2-(2,4-dimethyl-N-methylsulfonylanilino)acetamide
CID 1322609
N-cyclopentyl-2-(2,5-dichloro-N-methylsulfonylanilino)acetamide
CID 23883978
N-cycloheptyl-2-(2,4,5-trichloro-N-methylsulfonylanilino)acetamide
CID 1249582
2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-cycloheptylacetamide
CID 2177494
N-cyclopentyl-2-[4-(diethylamino)-2-methyl-N-methylsulfonylanilino]acetamide
CID 113157058
N-cyclopentyl-2-(2,4-dimethoxy-N-methylsulfonylanilino)acetamide
CID 1095298
N-cyclohexyl-2-(2,3-dimethyl-N-methylsulfonylanilino)acetamide
CID 700395
N-cyclopentyl-2-(2-ethoxy-N-methylsulfonylanilino)acetamide
CID 846470
2-(2,4-difluoro-N-methylsulfonylanilino)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 100570627
2-(2,4-difluoro-N-methylsulfonylanilino)-N-(2,2-dimethyl-3,4-dihydrochromen-4-yl)acetamide
CID 132667340
N-cycloheptyl-2-[N-(dimethylsulfamoyl)-4-fluoroanilino]acetamide
CID 46364516

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide?
The IUPAC name of N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide (CID 113156765) is N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide?
The canonical SMILES for N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide is CS(=O)(=O)N(CC(=O)NC1CCCCC1)c1ccc(F)cc1F.
What is the InChIKey of N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide?
The InChIKey is DBWKIPHRTZHHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O3S/c1-23(21,22)19(14-8-7-11(16)9-13(14)17)10-15(20)18-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,18,20).
What are the key properties of N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide?
N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide has a molecular weight of 346.40 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2,4-difluoro-N-methylsulfonylanilino)acetamide is sourced from PubChem (CID 113156765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).