2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide

C12H17ClN2O3S — CID 47320271

IUPAC2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C12H17ClN2O3S/c1-14(2)19(16,17)15-7-8-18-12(9-15)10-3-5-11(13)6-4-10/h3-6,12H,7-9H2,1-2H3
InChIKeyDIJGMUCPQYLTAW-UHFFFAOYSA-N
MW304.80 g/mol
LogP1.52
Rot. Bonds3

About 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide

2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide (PubChem CID 47320271) has the molecular formula C12H17ClN2O3S and a molecular weight of 304.80 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide
PubChem CID47320271
Molecular FormulaC12H17ClN2O3S
Molecular Weight304.80 g/mol
Exact Mass304.06
IUPAC Name2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C12H17ClN2O3S/c1-14(2)19(16,17)15-7-8-18-12(9-15)10-3-5-11(13)6-4-10/h3-6,12H,7-9H2,1-2H3
InChIKeyDIJGMUCPQYLTAW-UHFFFAOYSA-N
XLogP1.52
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.80
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-(4-methylphenyl)morpholine-4-sulfonamide
CID 110326565
2-(4-chlorophenyl)-N-propylmorpholine-4-sulfonamide
CID 110609493
2-[5-[2-(4-chlorophenoxy)ethyl]-1-methylpyrazol-3-yl]-N,N-dimethylmorpholine-4-sulfonamide
CID 127248548
3-[2-(4-chlorophenyl)morpholin-4-yl]sulfonylpropanoic acid
CID 60952065
(2R)-2-(4-chlorophenyl)-4-(1,2-dimethylimidazol-4-yl)sulfonylmorpholine
CID 95167565
3-(4-chlorophenyl)-N,N-dimethylazepane-1-sulfonamide
CID 121146773
N,N-dimethyl-2-(2-methylpyrimidin-4-yl)morpholine-4-sulfonamide
CID 110096221
(2S)-2-[6-(dimethylamino)-2-pyridinyl]-N,N-dimethylmorpholine-4-sulfonamide
CID 125014937
2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine
CID 110327129
3-[2-(4-chlorophenyl)morpholin-4-yl]sulfonylbenzoic acid
CID 110416888
2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethylmorpholine-4-sulfonamide
CID 110115941
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 95205970

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide?
The IUPAC name of 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide (CID 47320271) is 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide?
The canonical SMILES for 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide is CN(C)S(=O)(=O)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide?
The InChIKey is DIJGMUCPQYLTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O3S/c1-14(2)19(16,17)15-7-8-18-12(9-15)10-3-5-11(13)6-4-10/h3-6,12H,7-9H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide?
2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide has a molecular weight of 304.80 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 47320271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).