2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride

C9H21ClN2O3S — CID 120998878

IUPAC2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride
SMILESCOC(C)CS(=O)(=O)NC1CCNCC1.Cl
InChIInChI=1S/C9H20N2O3S.ClH/c1-8(14-2)7-15(12,13)11-9-3-5-10-6-4-9;/h8-11H,3-7H2,1-2H3;1H
InChIKeySIZHLLGIAAGAAS-UHFFFAOYSA-N
MW272.80 g/mol
LogP0.11
Rot. Bonds5

About 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride

2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride (PubChem CID 120998878) has the molecular formula C9H21ClN2O3S and a molecular weight of 272.80 g/mol. Its IUPAC name is 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride
PubChem CID120998878
Molecular FormulaC9H21ClN2O3S
Molecular Weight272.80 g/mol
Exact Mass272.10
IUPAC Name2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride
SMILESCOC(C)CS(=O)(=O)NC1CCNCC1.Cl
InChIInChI=1S/C9H20N2O3S.ClH/c1-8(14-2)7-15(12,13)11-9-3-5-10-6-4-9;/h8-11H,3-7H2,1-2H3;1H
InChIKeySIZHLLGIAAGAAS-UHFFFAOYSA-N
XLogP0.11
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.80
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methoxy-N-piperidin-4-ylpropane-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

ethane;molecular hydrogen;N-piperidin-4-ylethanesulfonamide
CID 144690216
2-ethoxy-N-piperidin-4-ylethanesulfonamide;hydrochloride
CID 119960526
2-methoxy-N-(2-methyloxolan-3-yl)propane-1-sulfonamide
CID 136540395
N-cyclohex-2-en-1-yl-2-methoxypropane-1-sulfonamide
CID 102564274
N-pyrrolidin-3-ylpropane-1-sulfonamide;hydrochloride
CID 50988223
(2R)-2-methoxy-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]propane-1-sulfonamide
CID 124735855
N-[(3R)-pyrrolidin-3-yl]ethanesulfonamide
CID 79684935
N-(2-methoxyethylsulfamoyl)piperidin-4-amine
CID 114814237
N-(4-methylcyclohexyl)-2-piperidin-4-ylethanesulfonamide
CID 60892687
2-(4-methylphenoxy)-N-piperidin-4-ylethanesulfonamide;hydrochloride
CID 154911253
methyl 3-[[(3S)-pyrrolidin-3-yl]sulfamoyl]propanoate
CID 79684956
methyl 3-(piperidin-4-ylsulfamoylmethyl)benzoate;hydrochloride
CID 119960840

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride?
The IUPAC name of 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride (CID 120998878) is 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride.
What is the SMILES notation for 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride?
The canonical SMILES for 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride is COC(C)CS(=O)(=O)NC1CCNCC1.Cl.
What is the InChIKey of 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride?
The InChIKey is SIZHLLGIAAGAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S.ClH/c1-8(14-2)7-15(12,13)11-9-3-5-10-6-4-9;/h8-11H,3-7H2,1-2H3;1H.
What are the key properties of 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride?
2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride has a molecular weight of 272.80 g/mol, XLogP of 0.11, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride is sourced from PubChem (CID 120998878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).