N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide

C16H25N3O4S — CID 119674988

IUPACN-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)C2CNCCO2)ccc1C
InChIInChI=1S/C16H25N3O4S/c1-4-19(5-2)24(21,22)15-10-13(7-6-12(15)3)18-16(20)14-11-17-8-9-23-14/h6-7,10,14,17H,4-5,8-9,11H2,1-3H3,(H,18,20)
InChIKeyGFWLOANOUGRCGK-UHFFFAOYSA-N
MW355.46 g/mol
LogP0.95
Rot. Bonds6

About N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide

N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide (PubChem CID 119674988) has the molecular formula C16H25N3O4S and a molecular weight of 355.46 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide
PubChem CID119674988
Molecular FormulaC16H25N3O4S
Molecular Weight355.46 g/mol
Exact Mass355.16
IUPAC NameN-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)C2CNCCO2)ccc1C
InChIInChI=1S/C16H25N3O4S/c1-4-19(5-2)24(21,22)15-10-13(7-6-12(15)3)18-16(20)14-11-17-8-9-23-14/h6-7,10,14,17H,4-5,8-9,11H2,1-3H3,(H,18,20)
InChIKeyGFWLOANOUGRCGK-UHFFFAOYSA-N
XLogP0.95
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.46
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(diethylsulfamoyl)-4-methylphenyl]piperidine-3-carboxamide;hydrochloride
CID 119263634
N-[3-(diethylsulfamoyl)-4-methylphenyl]oxane-4-carboxamide
CID 31973095
(2R)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 26708035
N-[3-(diethylsulfamoyl)-4-methylphenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide
CID 3920148
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-[3-(dimethylsulfamoyl)-4-methylphenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119675216
N-[3-(dimethylsulfamoyl)-4-methylphenyl]oxolane-2-carboxamide
CID 42904547
N-[3-(diethylsulfamoyl)-4-methylphenyl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 46586044
N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 46665709
N-[3-(diethylsulfamoyl)-4-methylphenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 17496304
N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675709
N-[2-methyl-5-(2-methylpropanoylamino)phenyl]morpholine-2-carboxamide
CID 119725786

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide?
The IUPAC name of N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide (CID 119674988) is N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide is CCN(CC)S(=O)(=O)c1cc(NC(=O)C2CNCCO2)ccc1C.
What is the InChIKey of N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide?
The InChIKey is GFWLOANOUGRCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O4S/c1-4-19(5-2)24(21,22)15-10-13(7-6-12(15)3)18-16(20)14-11-17-8-9-23-14/h6-7,10,14,17H,4-5,8-9,11H2,1-3H3,(H,18,20).
What are the key properties of N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide?
N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide has a molecular weight of 355.46 g/mol, XLogP of 0.95, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)-4-methylphenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119674988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).