N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide

C19H22N2O4S — CID 47958927

IUPACN-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CC(C)OC(c3ccccc3)C2)cc1
InChIInChI=1S/C19H22N2O4S/c1-14-12-21(13-19(25-14)16-6-4-3-5-7-16)26(23,24)18-10-8-17(9-11-18)20-15(2)22/h3-11,14,19H,12-13H2,1-2H3,(H,20,22)
InChIKeyUTUZMYFFXCSWHZ-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.80
Rot. Bonds4

About N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide

N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide (PubChem CID 47958927) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide
PubChem CID47958927
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CC(C)OC(c3ccccc3)C2)cc1
InChIInChI=1S/C19H22N2O4S/c1-14-12-21(13-19(25-14)16-6-4-3-5-7-16)26(23,24)18-10-8-17(9-11-18)20-15(2)22/h3-11,14,19H,12-13H2,1-2H3,(H,20,22)
InChIKeyUTUZMYFFXCSWHZ-UHFFFAOYSA-N
XLogP2.80
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,6S)-2-methyl-4-(4-nitrophenyl)sulfonyl-6-phenylmorpholine
CID 95220723
4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-phenylbenzamide
CID 40606298
N-[4-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]sulfonylphenyl]acetamide
CID 43063026
4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-phenylbenzamide
CID 6463291
3-(benzenesulfonyl)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]propanamide
CID 26918163
N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-2-fluorobenzamide
CID 51152550
N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-4-phenylbenzamide
CID 167754266
4-(4-fluoro-3-methylphenyl)sulfonyl-2-methyl-6-phenylmorpholine
CID 110369020
N-[4-(2-phenylaziridin-1-yl)sulfonylphenyl]acetamide
CID 24882129
N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-2-methylcyclopropane-1-carboxamide
CID 51152560
N-[4-(4-benzyl-3,5-dimethylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 110657741
2-[4-(2,6-dimethylmorpholin-4-yl)sulfonylanilino]-1-phenylethanone
CID 110825143

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide?
The IUPAC name of N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide (CID 47958927) is N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide.
What is the SMILES notation for N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide?
The canonical SMILES for N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N2CC(C)OC(c3ccccc3)C2)cc1.
What is the InChIKey of N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide?
The InChIKey is UTUZMYFFXCSWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-14-12-21(13-19(25-14)16-6-4-3-5-7-16)26(23,24)18-10-8-17(9-11-18)20-15(2)22/h3-11,14,19H,12-13H2,1-2H3,(H,20,22).
What are the key properties of N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide?
N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide has a molecular weight of 374.46 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide is sourced from PubChem (CID 47958927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).