N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide

C13H20N2O3S — CID 110326565

IUPACN,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide
SMILESCc1ccc(C2CN(S(=O)(=O)N(C)C)CCO2)cc1
InChIInChI=1S/C13H20N2O3S/c1-11-4-6-12(7-5-11)13-10-15(8-9-18-13)19(16,17)14(2)3/h4-7,13H,8-10H2,1-3H3
InChIKeyMEYNDQCOLCWMRJ-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.17
Rot. Bonds3

About N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide

N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide (PubChem CID 110326565) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide
PubChem CID110326565
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC NameN,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide
SMILESCc1ccc(C2CN(S(=O)(=O)N(C)C)CCO2)cc1
InChIInChI=1S/C13H20N2O3S/c1-11-4-6-12(7-5-11)13-10-15(8-9-18-13)19(16,17)14(2)3/h4-7,13H,8-10H2,1-3H3
InChIKeyMEYNDQCOLCWMRJ-UHFFFAOYSA-N
XLogP1.17
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide
CID 47320271
2-(4-methylphenyl)-4-(4-methylphenyl)sulfonylmorpholine
CID 110326567
N,N-dimethyl-2-(2-methylpyrimidin-4-yl)morpholine-4-sulfonamide
CID 110096221
4-(4-bromophenyl)sulfonyl-2-(4-methylphenyl)morpholine
CID 110326570
2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethylmorpholine-4-sulfonamide
CID 110115941
(2S)-2-[6-(dimethylamino)-2-pyridinyl]-N,N-dimethylmorpholine-4-sulfonamide
CID 125014937
N-[4-[2-(4-methylphenyl)morpholin-4-yl]sulfonylphenyl]acetamide
CID 110326603
2-(4-methylphenyl)-4-(3-phenylpropylsulfonyl)morpholine
CID 110326607
4-[2-(4-methoxyphenyl)ethylsulfonyl]-2-(4-methylphenyl)morpholine
CID 121134912
N,N-dimethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)morpholine-4-sulfonamide
CID 136844285
2-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-N,N-dimethylmorpholine-4-sulfonamide
CID 110093067
4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]morpholin-2-yl]-N,N-dimethylaniline
CID 110364286

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide?
The IUPAC name of N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide (CID 110326565) is N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide.
What is the SMILES notation for N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide?
The canonical SMILES for N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide is Cc1ccc(C2CN(S(=O)(=O)N(C)C)CCO2)cc1.
What is the InChIKey of N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide?
The InChIKey is MEYNDQCOLCWMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-11-4-6-12(7-5-11)13-10-15(8-9-18-13)19(16,17)14(2)3/h4-7,13H,8-10H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide?
N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide has a molecular weight of 284.38 g/mol, XLogP of 1.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide is sourced from PubChem (CID 110326565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).