N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide

C19H22N2O4S — CID 110326603

IUPACN-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCOC(c3ccc(C)cc3)C2)cc1
InChIInChI=1S/C19H22N2O4S/c1-14-3-5-16(6-4-14)19-13-21(11-12-25-19)26(23,24)18-9-7-17(8-10-18)20-15(2)22/h3-10,19H,11-13H2,1-2H3,(H,20,22)
InChIKeyWITGGKFMXSEQOU-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.72
Rot. Bonds4

About N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide

N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide (PubChem CID 110326603) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide
PubChem CID110326603
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCOC(c3ccc(C)cc3)C2)cc1
InChIInChI=1S/C19H22N2O4S/c1-14-3-5-16(6-4-14)19-13-21(11-12-25-19)26(23,24)18-9-7-17(8-10-18)20-15(2)22/h3-10,19H,11-13H2,1-2H3,(H,20,22)
InChIKeyWITGGKFMXSEQOU-UHFFFAOYSA-N
XLogP2.72
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 ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenyl)-4-(4-methylphenyl)sulfonylmorpholine
CID 110326567
4-(4-bromophenyl)sulfonyl-2-(4-methylphenyl)morpholine
CID 110326570
N-[4-[(2S)-2-phenylmorpholin-4-yl]sulfonylphenyl]butanamide
CID 25281428
N-[4-[2-(chloromethyl)morpholin-4-yl]sulfonylphenyl]acetamide
CID 81214143
1-[4-[2-(4-fluorophenyl)morpholin-4-yl]sulfonylphenyl]ethanone
CID 42949946
methyl (2R)-4-(4-methylphenyl)sulfonylmorpholine-2-carboxylate
CID 171059500
(2R)-2-(4,6-dimethylpyrimidin-2-yl)-4-(4-methylphenyl)sulfonylmorpholine
CID 124999153
N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide
CID 110326565
N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide
CID 47958927
N-[4-[4-[(4-methylphenyl)carbamoylamino]piperidin-1-yl]sulfonylphenyl]acetamide
CID 24612546
N-methyl-3-[(2R)-4-(4-methylphenyl)sulfonylmorpholin-2-yl]pyrazin-2-amine
CID 124974810
1-[4-[2-(3,5-dichlorophenyl)morpholin-4-yl]sulfonylphenyl]ethanone
CID 121134630

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide?
The IUPAC name of N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide (CID 110326603) is N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide.
What is the SMILES notation for N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide?
The canonical SMILES for N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N2CCOC(c3ccc(C)cc3)C2)cc1.
What is the InChIKey of N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide?
The InChIKey is WITGGKFMXSEQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-14-3-5-16(6-4-14)19-13-21(11-12-25-19)26(23,24)18-9-7-17(8-10-18)20-15(2)22/h3-10,19H,11-13H2,1-2H3,(H,20,22).
What are the key properties of N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide?
N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide has a molecular weight of 374.46 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide is sourced from PubChem (CID 110326603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).