2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide

C12H17ClN2O3S — CID 110609436

IUPAC2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide
SMILESCCNS(=O)(=O)N1CCOC(c2ccccc2Cl)C1
InChIInChI=1S/C12H17ClN2O3S/c1-2-14-19(16,17)15-7-8-18-12(9-15)10-5-3-4-6-11(10)13/h3-6,12,14H,2,7-9H2,1H3
InChIKeyMYMSPACKOADMRT-UHFFFAOYSA-N
MW304.80 g/mol
LogP1.57
Rot. Bonds4

About 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide

2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide (PubChem CID 110609436) has the molecular formula C12H17ClN2O3S and a molecular weight of 304.80 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide
PubChem CID110609436
Molecular FormulaC12H17ClN2O3S
Molecular Weight304.80 g/mol
Exact Mass304.06
IUPAC Name2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide
SMILESCCNS(=O)(=O)N1CCOC(c2ccccc2Cl)C1
InChIInChI=1S/C12H17ClN2O3S/c1-2-14-19(16,17)15-7-8-18-12(9-15)10-5-3-4-6-11(10)13/h3-6,12,14H,2,7-9H2,1H3
InChIKeyMYMSPACKOADMRT-UHFFFAOYSA-N
XLogP1.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.80
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonylmorpholine
CID 110326898
2-(2-chlorophenyl)-4-(3-chlorophenyl)sulfonylmorpholine
CID 110326938
2-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)sulfonylmorpholine
CID 110326908
2-(4-chlorophenyl)-N-propylmorpholine-4-sulfonamide
CID 110609493
2-(3-chlorophenyl)-N-propylmorpholine-4-sulfonamide
CID 110609463
1-[2-(2-chlorophenyl)morpholin-4-yl]butan-1-one
CID 110326823
2-(2-chlorophenyl)-N-(2-methylpropyl)morpholine-4-carboxamide
CID 110609422
5-[2-(2-chlorophenyl)morpholin-4-yl]sulfonyl-1,3-dihydroindol-2-one
CID 110326932
4-(2-bromophenyl)-N-ethylpiperidine-1-sulfonamide
CID 99823659
(2-chlorophenyl)-[2-(2-chlorophenyl)morpholin-4-yl]methanone
CID 110326868
4-butylsulfonyl-2-(2-fluorophenyl)morpholine
CID 110326692
(2S)-2-[(2R)-2-(2-chlorophenyl)morpholin-4-yl]propanoic acid
CID 125152344

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide?
The IUPAC name of 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide (CID 110609436) is 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide is CCNS(=O)(=O)N1CCOC(c2ccccc2Cl)C1.
What is the InChIKey of 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide?
The InChIKey is MYMSPACKOADMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O3S/c1-2-14-19(16,17)15-7-8-18-12(9-15)10-5-3-4-6-11(10)13/h3-6,12,14H,2,7-9H2,1H3.
What are the key properties of 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide?
2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide has a molecular weight of 304.80 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-ethylmorpholine-4-sulfonamide is sourced from PubChem (CID 110609436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).