N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide

C18H28N2O4S — CID 90607497

IUPACN-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)N(CCN1CCOCC1)C1CCOCC1
InChIInChI=1S/C18H28N2O4S/c21-25(22,16-17-4-2-1-3-5-17)20(18-6-12-23-13-7-18)9-8-19-10-14-24-15-11-19/h1-5,18H,6-16H2
InChIKeyYETWHVGCIGOJPE-UHFFFAOYSA-N
MW368.50 g/mol
LogP1.33
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide

N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide (PubChem CID 90607497) has the molecular formula C18H28N2O4S and a molecular weight of 368.50 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide
PubChem CID90607497
Molecular FormulaC18H28N2O4S
Molecular Weight368.50 g/mol
Exact Mass368.18
IUPAC NameN-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)N(CCN1CCOCC1)C1CCOCC1
InChIInChI=1S/C18H28N2O4S/c21-25(22,16-17-4-2-1-3-5-17)20(18-6-12-23-13-7-18)9-8-19-10-14-24-15-11-19/h1-5,18H,6-16H2
InChIKeyYETWHVGCIGOJPE-UHFFFAOYSA-N
XLogP1.33
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.50
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)naphthalene-2-sulfonamide
CID 90607494
2-[benzylsulfonyl(2-morpholin-4-ylethyl)amino]-N-hydroxyacetamide
CID 57069387
N-cyclopropyl-N-[2-(3-fluorophenyl)ethyl]-3-morpholin-4-ylpropane-1-sulfonamide
CID 75450390
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-3-(trifluoromethyl)benzenesulfonamide
CID 90607520
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)propane-2-sulfonamide
CID 90607519
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)furan-2-carboxamide
CID 90607378
N-cyclobutyl-N-(3-hydroxypropyl)-1-phenylmethanesulfonamide
CID 102847511
3,4-dimethoxy-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)benzenesulfonamide
CID 90607489
N-(3-aminopropyl)-N-cyclopentyl-1-phenylmethanesulfonamide
CID 43319471
methyl 4-[2-morpholin-4-ylethyl(oxan-4-yl)sulfamoyl]benzoate
CID 90607533
2-(3-methylphenyl)-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)acetamide
CID 90607368
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide
CID 90607349

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide (CID 90607497) is N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide is O=S(=O)(Cc1ccccc1)N(CCN1CCOCC1)C1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide?
The InChIKey is YETWHVGCIGOJPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O4S/c21-25(22,16-17-4-2-1-3-5-17)20(18-6-12-23-13-7-18)9-8-19-10-14-24-15-11-19/h1-5,18H,6-16H2.
What are the key properties of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide?
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide has a molecular weight of 368.50 g/mol, XLogP of 1.33, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-1-phenylmethanesulfonamide is sourced from PubChem (CID 90607497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).