N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide

C11H17N3O3S — CID 94177903

IUPACN-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide
SMILESC[C@H](NS(=O)(=O)N1CCOCC1)c1cccnc1
InChIInChI=1S/C11H17N3O3S/c1-10(11-3-2-4-12-9-11)13-18(15,16)14-5-7-17-8-6-14/h2-4,9-10,13H,5-8H2,1H3/t10-/m0/s1
InChIKeyWJBDYYSGDFCAEW-JTQLQIEISA-N
MW271.34 g/mol
LogP0.31
Rot. Bonds4

About N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide

N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide (PubChem CID 94177903) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide
PubChem CID94177903
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC NameN-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide
SMILESC[C@H](NS(=O)(=O)N1CCOCC1)c1cccnc1
InChIInChI=1S/C11H17N3O3S/c1-10(11-3-2-4-12-9-11)13-18(15,16)14-5-7-17-8-6-14/h2-4,9-10,13H,5-8H2,1H3/t10-/m0/s1
InChIKeyWJBDYYSGDFCAEW-JTQLQIEISA-N
XLogP0.31
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-pyridin-3-ylethyl)morpholine-4-carboxamide
CID 115576612
4-methyl-N-(2-methyl-1-pyridin-3-ylpropyl)piperazine-1-sulfonamide
CID 122560524
N-[1-(4-ethylphenyl)ethyl]morpholine-4-sulfonamide
CID 47141626
N-[3-[1-(morpholin-4-ylsulfonylamino)ethyl]phenyl]acetamide
CID 46595994
N-[(1S)-3-methyl-1-pyridin-3-ylbutyl]pyrrolidine-1-sulfonamide
CID 125443435
N-(1-thiophen-2-ylethyl)morpholine-4-sulfonamide
CID 47141625
N-[(2R)-2-morpholin-4-ylpropyl]-N'-[(1R)-1-pyridin-3-ylethyl]oxamide
CID 124878270
2-chloro-N-[(1S)-1-pyridin-3-ylethyl]ethanesulfonamide
CID 107858694
2-hydroxy-N-(1-pyridin-3-ylethyl)ethanesulfonamide
CID 79588957
2-[[(1S)-1-pyridin-3-ylethyl]sulfamoyl]acetic acid
CID 81406791
N-(ethylsulfamoyl)-2-morpholin-4-yl-2-pyridin-3-ylethanamine
CID 110623720
2,6-difluoro-N-(1-pyridin-3-ylethyl)benzenesulfonamide
CID 47111106

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide?
The IUPAC name of N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide (CID 94177903) is N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide is C[C@H](NS(=O)(=O)N1CCOCC1)c1cccnc1.
What is the InChIKey of N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide?
The InChIKey is WJBDYYSGDFCAEW-JTQLQIEISA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-10(11-3-2-4-12-9-11)13-18(15,16)14-5-7-17-8-6-14/h2-4,9-10,13H,5-8H2,1H3/t10-/m0/s1.
What are the key properties of N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide?
N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide has a molecular weight of 271.34 g/mol, XLogP of 0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-pyridin-3-ylethyl]morpholine-4-sulfonamide is sourced from PubChem (CID 94177903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).