N-[3-(ethylamino)propyl]morpholine-4-sulfonamide

C9H21N3O3S — CID 43606633

IUPACN-[3-(ethylamino)propyl]morpholine-4-sulfonamide
SMILESCCNCCCNS(=O)(=O)N1CCOCC1
InChIInChI=1S/C9H21N3O3S/c1-2-10-4-3-5-11-16(13,14)12-6-8-15-9-7-12/h10-11H,2-9H2,1H3
InChIKeyLHEKGLMRTGPIRO-UHFFFAOYSA-N
MW251.35 g/mol
LogP-0.85
Rot. Bonds7

About N-[3-(ethylamino)propyl]morpholine-4-sulfonamide

N-[3-(ethylamino)propyl]morpholine-4-sulfonamide (PubChem CID 43606633) has the molecular formula C9H21N3O3S and a molecular weight of 251.35 g/mol. Its IUPAC name is N-[3-(ethylamino)propyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[3-(ethylamino)propyl]morpholine-4-sulfonamide
PubChem CID43606633
Molecular FormulaC9H21N3O3S
Molecular Weight251.35 g/mol
Exact Mass251.13
IUPAC NameN-[3-(ethylamino)propyl]morpholine-4-sulfonamide
SMILESCCNCCCNS(=O)(=O)N1CCOCC1
InChIInChI=1S/C9H21N3O3S/c1-2-10-4-3-5-11-16(13,14)12-6-8-15-9-7-12/h10-11H,2-9H2,1H3
InChIKeyLHEKGLMRTGPIRO-UHFFFAOYSA-N
XLogP-0.85
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(propan-2-ylamino)propyl]morpholine-4-sulfonamide
CID 43606820
N-(3-iodopropyl)morpholine-4-sulfonamide
CID 114504667
N-[2-(ethylamino)ethyl]azepane-1-sulfonamide
CID 62665481
N-[2-(dimethylamino)ethyl]morpholine-4-sulfonamide
CID 110705984
7-(morpholin-4-ylsulfonylamino)heptanoic acid
CID 28784453
N-[2-(2-methoxyethylamino)ethyl]morpholine-4-sulfonamide;hydrochloride
CID 120717809
ethane;N-ethyl-3-morpholin-4-ylpropan-1-amine
CID 170595450
N-[2-(ethylamino)ethyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 119973419
N-(2,2-diethoxyethyl)morpholine-4-sulfonamide
CID 79548082
N-[2-(ethylamino)ethyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide;hydrochloride
CID 119973418
N-[3-(ethylsulfonylamino)propyl]azepane-1-sulfonamide
CID 49459638
N-[2-(3-hydroxypropylsulfanyl)ethyl]morpholine-4-sulfonamide
CID 103834903

Frequently Asked Questions

What is the IUPAC name of N-[3-(ethylamino)propyl]morpholine-4-sulfonamide?
The IUPAC name of N-[3-(ethylamino)propyl]morpholine-4-sulfonamide (CID 43606633) is N-[3-(ethylamino)propyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[3-(ethylamino)propyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[3-(ethylamino)propyl]morpholine-4-sulfonamide is CCNCCCNS(=O)(=O)N1CCOCC1.
What is the InChIKey of N-[3-(ethylamino)propyl]morpholine-4-sulfonamide?
The InChIKey is LHEKGLMRTGPIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O3S/c1-2-10-4-3-5-11-16(13,14)12-6-8-15-9-7-12/h10-11H,2-9H2,1H3.
What are the key properties of N-[3-(ethylamino)propyl]morpholine-4-sulfonamide?
N-[3-(ethylamino)propyl]morpholine-4-sulfonamide has a molecular weight of 251.35 g/mol, XLogP of -0.85, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(ethylamino)propyl]morpholine-4-sulfonamide is sourced from PubChem (CID 43606633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).