N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride

C11H26ClN3O3S — CID 120717614

IUPACN-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCOCCNCCNS(=O)(=O)N1CCCCC1C.Cl
InChIInChI=1S/C11H25N3O3S.ClH/c1-11-5-3-4-9-14(11)18(15,16)13-7-6-12-8-10-17-2;/h11-13H,3-10H2,1-2H3;1H
InChIKeyMVLHYDAIWQXVFF-UHFFFAOYSA-N
MW315.87 g/mol
LogP0.35
Rot. Bonds8

About N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride

N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride (PubChem CID 120717614) has the molecular formula C11H26ClN3O3S and a molecular weight of 315.87 g/mol. Its IUPAC name is N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride
PubChem CID120717614
Molecular FormulaC11H26ClN3O3S
Molecular Weight315.87 g/mol
Exact Mass315.14
IUPAC NameN-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCOCCNCCNS(=O)(=O)N1CCCCC1C.Cl
InChIInChI=1S/C11H25N3O3S.ClH/c1-11-5-3-4-9-14(11)18(15,16)13-7-6-12-8-10-17-2;/h11-13H,3-10H2,1-2H3;1H
InChIKeyMVLHYDAIWQXVFF-UHFFFAOYSA-N
XLogP0.35
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.87
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2-methylpiperidin-1-yl)propyl]morpholine-4-sulfonamide
CID 71896054
N-[[1-(difluoromethylsulfonyl)piperidin-2-yl]methyl]-2-methoxyethanamine
CID 63878441
2-(methylaminomethyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-1-sulfonamide
CID 106064659
N-[2-(2,2-difluoroethoxy)ethyl]-2-(ethylaminomethyl)piperidine-1-sulfonamide
CID 106091873
N-[2-(2,2-difluoroethoxy)ethyl]-2-(methylaminomethyl)piperidine-1-sulfonamide
CID 106091946
2-[(2-methoxyethylamino)methyl]-N-(2,2,2-trifluoroethyl)piperidine-1-sulfonamide
CID 114813135
N-(2-methoxyethylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine
CID 114815040
N-(morpholin-3-ylmethyl)hexan-1-amine
CID 53955070
4-(2-methoxyethylamino)-N,N-dimethylpiperidine-1-sulfonamide
CID 60043439
2-methoxy-N-(piperidin-2-ylmethyl)ethanamine
CID 62544316
N-[[1-(2-ethoxyethyl)piperidin-2-yl]methyl]propan-2-amine
CID 62581842
4-amino-N-(2-methoxyethyl)piperidine-1-sulfonamide
CID 114813689

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride (CID 120717614) is N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride is COCCNCCNS(=O)(=O)N1CCCCC1C.Cl.
What is the InChIKey of N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride?
The InChIKey is MVLHYDAIWQXVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O3S.ClH/c1-11-5-3-4-9-14(11)18(15,16)13-7-6-12-8-10-17-2;/h11-13H,3-10H2,1-2H3;1H.
What are the key properties of N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride?
N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride has a molecular weight of 315.87 g/mol, XLogP of 0.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethylamino)ethyl]-2-methylpiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 120717614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).