N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride

C9H22ClN3O4S — CID 120717809

IUPACN-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride
SMILESCOCCNCCNS(=O)(=O)N1CCOCC1.Cl
InChIInChI=1S/C9H21N3O4S.ClH/c1-15-7-4-10-2-3-11-17(13,14)12-5-8-16-9-6-12;/h10-11H,2-9H2,1H3;1H
InChIKeyJSTSPRYFVPQBRQ-UHFFFAOYSA-N
MW303.81 g/mol
LogP-1.19
Rot. Bonds8

About N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride

N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride (PubChem CID 120717809) has the molecular formula C9H22ClN3O4S and a molecular weight of 303.81 g/mol. Its IUPAC name is N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride
PubChem CID120717809
Molecular FormulaC9H22ClN3O4S
Molecular Weight303.81 g/mol
Exact Mass303.10
IUPAC NameN-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride
SMILESCOCCNCCNS(=O)(=O)N1CCOCC1.Cl
InChIInChI=1S/C9H21N3O4S.ClH/c1-15-7-4-10-2-3-11-17(13,14)12-5-8-16-9-6-12;/h10-11H,2-9H2,1H3;1H
InChIKeyJSTSPRYFVPQBRQ-UHFFFAOYSA-N
XLogP-1.19
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.81
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-chloro-4-methoxybutyl)morpholine-4-sulfonamide
CID 106245433
N-(2-methoxyethyl)azetidine-1-sulfonamide
CID 164583733
N-[3-(ethylamino)propyl]morpholine-4-sulfonamide
CID 43606633
N-[2-(dimethylamino)ethyl]morpholine-4-sulfonamide
CID 110705984
N-[2-(2-chloroethoxy)ethyl]morpholine-4-sulfonamide
CID 65033687
N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride
CID 120717614
N-(3-iodopropyl)morpholine-4-sulfonamide
CID 114504667
N-(3-methoxypropyl)pyrrolidine-1-sulfonamide
CID 110705733
N-[3-(propan-2-ylamino)propyl]morpholine-4-sulfonamide
CID 43606820
2-(1-aminoethyl)-N-(2-methoxyethyl)morpholine-4-sulfonamide
CID 114816234
4-(ethylamino)-N-(2-methoxyethyl)piperidine-1-sulfonamide
CID 114813693
2-(2-methoxyethylamino)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]acetamide;hydrochloride
CID 119690162

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride?
The IUPAC name of N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride (CID 120717809) is N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride.
What is the SMILES notation for N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride?
The canonical SMILES for N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride is COCCNCCNS(=O)(=O)N1CCOCC1.Cl.
What is the InChIKey of N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride?
The InChIKey is JSTSPRYFVPQBRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O4S.ClH/c1-15-7-4-10-2-3-11-17(13,14)12-5-8-16-9-6-12;/h10-11H,2-9H2,1H3;1H.
What are the key properties of N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride?
N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride has a molecular weight of 303.81 g/mol, XLogP of -1.19, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride is sourced from PubChem (CID 120717809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).