N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide

C18H29N3O4S — CID 8899897

IUPACN-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)CN2C[C@@H](C)O[C@H](C)C2)c1
InChIInChI=1S/C18H29N3O4S/c1-5-21(6-2)26(23,24)17-9-7-8-16(10-17)19-18(22)13-20-11-14(3)25-15(4)12-20/h7-10,14-15H,5-6,11-13H2,1-4H3,(H,19,22)/t14-,15-/m1/s1
InChIKeyULCDDOJMVZECKX-HUUCEWRRSA-N
MW383.51 g/mol
LogP1.76
Rot. Bonds7

About N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide

N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide (PubChem CID 8899897) has the molecular formula C18H29N3O4S and a molecular weight of 383.51 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
PubChem CID8899897
Molecular FormulaC18H29N3O4S
Molecular Weight383.51 g/mol
Exact Mass383.19
IUPAC NameN-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)CN2C[C@@H](C)O[C@H](C)C2)c1
InChIInChI=1S/C18H29N3O4S/c1-5-21(6-2)26(23,24)17-9-7-8-16(10-17)19-18(22)13-20-11-14(3)25-15(4)12-20/h7-10,14-15H,5-6,11-13H2,1-4H3,(H,19,22)/t14-,15-/m1/s1
InChIKeyULCDDOJMVZECKX-HUUCEWRRSA-N
XLogP1.76
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.51
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(diethylsulfamoyl)phenyl]-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930625
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-(3-sulfamoylphenyl)acetamide
CID 7810409
3-[[2-(2,6-dimethylmorpholin-4-yl)acetyl]amino]-N-ethylbenzamide
CID 47010706
2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 8930825
N-[3-(diethylsulfamoyl)phenyl]-2-(3,3-dimethylmorpholin-4-yl)acetamide
CID 55987245
N-[3-(diethylsulfamoyl)phenyl]-2-(2-phenylpyrrolidin-1-yl)acetamide
CID 55499255
N-[3-(diethylsulfamoyl)phenyl]-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 3899374
2-(2,6-dimethylmorpholin-4-yl)-N-(3,4-dimethylphenyl)acetamide
CID 6465799
N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2681860
2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N-(4-ethylphenyl)acetamide
CID 8899824
N-[3-(diethylsulfamoyl)phenyl]-2-[(2R)-2-methylpiperidin-1-ium-1-yl]acetamide
CID 8583324
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)acetamide
CID 43039531

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide?
The IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide (CID 8899897) is N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)CN2C[C@@H](C)O[C@H](C)C2)c1.
What is the InChIKey of N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide?
The InChIKey is ULCDDOJMVZECKX-HUUCEWRRSA-N. The full InChI is InChI=1S/C18H29N3O4S/c1-5-21(6-2)26(23,24)17-9-7-8-16(10-17)19-18(22)13-20-11-14(3)25-15(4)12-20/h7-10,14-15H,5-6,11-13H2,1-4H3,(H,19,22)/t14-,15-/m1/s1.
What are the key properties of N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide?
N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide has a molecular weight of 383.51 g/mol, XLogP of 1.76, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)phenyl]-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide is sourced from PubChem (CID 8899897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).