(2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide

C15H23N3O4S — CID 94030007

IUPAC(2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide
SMILESCC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)CCO1
InChIInChI=1S/C15H23N3O4S/c1-3-13-10-18(8-9-22-13)15(19)17-11(2)12-4-6-14(7-5-12)23(16,20)21/h4-7,11,13H,3,8-10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-,13-/m1/s1
InChIKeyQJZRCQFMPGAELD-DGCLKSJQSA-N
MW341.43 g/mol
LogP1.22
Rot. Bonds4

About (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide

(2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide (PubChem CID 94030007) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide
PubChem CID94030007
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC Name(2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide
SMILESCC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)CCO1
InChIInChI=1S/C15H23N3O4S/c1-3-13-10-18(8-9-22-13)15(19)17-11(2)12-4-6-14(7-5-12)23(16,20)21/h4-7,11,13H,3,8-10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-,13-/m1/s1
InChIKeyQJZRCQFMPGAELD-DGCLKSJQSA-N
XLogP1.22
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]-1,4-diazepane-1-carboxamide
CID 95134251
2-[(2-ethylmorpholine-4-carbonyl)amino]-3-methylpentanoic acid
CID 61203036
(2-ethylmorpholin-4-yl)-(4-methylsulfonylphenyl)methanone
CID 43070670
2-[(2-ethylmorpholine-4-carbonyl)amino]-2-(1-methylpyrazol-4-yl)acetic acid
CID 115289122
2-[(2-ethyl-1,4-oxazepane-4-carbonyl)amino]-3-methylbutanoic acid
CID 114218615
2-(aminomethyl)-N-propan-2-ylmorpholine-4-carboxamide
CID 61337402
2-[4-(1-pyridin-3-ylethylcarbamoyl)morpholin-2-yl]acetic acid
CID 66434836
2-bromo-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 107903643
1,1-diethyl-3-[(1R)-1-(4-sulfamoylphenyl)ethyl]urea
CID 129375380
N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide
CID 82506232
(2R)-1-[(2S)-2-ethylmorpholin-4-yl]-2-methylsulfonylpropan-1-one
CID 95153981
(2S)-2-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]hexanamide
CID 124846028

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide?
The IUPAC name of (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide (CID 94030007) is (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide is CC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)CCO1.
What is the InChIKey of (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide?
The InChIKey is QJZRCQFMPGAELD-DGCLKSJQSA-N. The full InChI is InChI=1S/C15H23N3O4S/c1-3-13-10-18(8-9-22-13)15(19)17-11(2)12-4-6-14(7-5-12)23(16,20)21/h4-7,11,13H,3,8-10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-,13-/m1/s1.
What are the key properties of (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide?
(2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide has a molecular weight of 341.43 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 94030007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).