N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide

C9H21N3O3S — CID 62688438

IUPACN-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)N(C)CCN)CC(C)O1
InChIInChI=1S/C9H21N3O3S/c1-8-6-12(7-9(2)15-8)16(13,14)11(3)5-4-10/h8-9H,4-7,10H2,1-3H3
InChIKeyABJAAQQUQAFHFO-UHFFFAOYSA-N
MW251.35 g/mol
LogP-0.77
Rot. Bonds4

About N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide

N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide (PubChem CID 62688438) has the molecular formula C9H21N3O3S and a molecular weight of 251.35 g/mol. Its IUPAC name is N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide
PubChem CID62688438
Molecular FormulaC9H21N3O3S
Molecular Weight251.35 g/mol
Exact Mass251.13
IUPAC NameN-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)N(C)CCN)CC(C)O1
InChIInChI=1S/C9H21N3O3S/c1-8-6-12(7-9(2)15-8)16(13,14)11(3)5-4-10/h8-9H,4-7,10H2,1-3H3
InChIKeyABJAAQQUQAFHFO-UHFFFAOYSA-N
XLogP-0.77
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 5-0.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-methylamino]acetamide
CID 94061320
(2S,6R)-N,N,2,6-tetramethylmorpholine-4-sulfonamide
CID 884474
N-(2-hydroxy-2-methylpropyl)-N,2,6-trimethylmorpholine-4-sulfonamide
CID 79386593
methyl 4-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-methylamino]butanoate
CID 94400725
methyl 4-[(2,6-dimethylmorpholin-4-yl)sulfonyl-methylamino]butanoate
CID 51075470
N-(2-aminoethyl)-2,6-dimethyl-N-(2-phenylethyl)morpholine-4-sulfonamide
CID 120895336
N,2,6-trimethyl-N-(2-phenoxyethyl)morpholine-4-sulfonamide
CID 51330696
N-(2-aminoethyl)-2,6-dimethyl-N-(2-phenylethyl)morpholine-4-sulfonamide;hydrochloride
CID 120895335
N-(3-aminopropyl)-N,2-dimethyl-1,4-oxazepane-4-sulfonamide
CID 62973769
N-(3-aminopropyl)-N,3,4,5-tetramethylpiperazine-1-sulfonamide
CID 114545497
N-(2-aminoethyl)-2,6-dimethylmorpholine-4-sulfonamide
CID 43603513
N-[(5-bromothiophen-2-yl)methyl]-N,2,6-trimethylmorpholine-4-sulfonamide
CID 47141073

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide?
The IUPAC name of N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide (CID 62688438) is N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide.
What is the SMILES notation for N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide?
The canonical SMILES for N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide is CC1CN(S(=O)(=O)N(C)CCN)CC(C)O1.
What is the InChIKey of N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide?
The InChIKey is ABJAAQQUQAFHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O3S/c1-8-6-12(7-9(2)15-8)16(13,14)11(3)5-4-10/h8-9H,4-7,10H2,1-3H3.
What are the key properties of N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide?
N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide has a molecular weight of 251.35 g/mol, XLogP of -0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 62688438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).