1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide

C14H22N2O3S — CID 63871482

IUPAC1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCCOC1CCNCC1
InChIInChI=1S/C14H22N2O3S/c17-20(18,12-13-4-2-1-3-5-13)16-10-11-19-14-6-8-15-9-7-14/h1-5,14-16H,6-12H2
InChIKeyAUQAJJPUPUGSHF-UHFFFAOYSA-N
MW298.41 g/mol
LogP0.87
Rot. Bonds7

About 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide

1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide (PubChem CID 63871482) has the molecular formula C14H22N2O3S and a molecular weight of 298.41 g/mol. Its IUPAC name is 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide.

Molecular Properties

Compound Name1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide
PubChem CID63871482
Molecular FormulaC14H22N2O3S
Molecular Weight298.41 g/mol
Exact Mass298.14
IUPAC Name1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCCOC1CCNCC1
InChIInChI=1S/C14H22N2O3S/c17-20(18,12-13-4-2-1-3-5-13)16-10-11-19-14-6-8-15-9-7-14/h1-5,14-16H,6-12H2
InChIKeyAUQAJJPUPUGSHF-UHFFFAOYSA-N
XLogP0.87
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide 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

2-ethylsulfonyl-N-(2-piperidin-4-yloxyethyl)aniline
CID 63870510
2-methylsulfonyl-N-(2-piperidin-4-yloxyethyl)ethanesulfonamide
CID 55252432
4-fluoro-N-(2-piperidin-4-yloxyethyl)benzenesulfonamide
CID 63870153
1-(3-aminophenyl)-N-(2-cyclohexyloxyethyl)methanesulfonamide
CID 63823532
3-cyano-N-(2-piperidin-4-yloxyethyl)benzenesulfonamide
CID 63870489
1-phenyl-N-(2-piperazin-1-ylethyl)methanesulfonamide
CID 43599791
methyl 2-(2-piperidin-4-yloxyethylsulfamoyl)acetate
CID 63870829
1-phenyl-N-(2-phenylmethoxyethyl)methanesulfonamide
CID 3764868
4-(3-phenylmethoxypropoxy)piperidine
CID 171491541
N-benzyl-N-methyl-2-piperidin-4-yloxyethanamine
CID 63903578
methyl 3-(2-piperidin-4-yloxyethylsulfamoyl)propanoate
CID 55250997
N-(2-cyclopentyloxyethyl)benzenesulfonamide
CID 61060137

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide?
The IUPAC name of 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide (CID 63871482) is 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide.
What is the SMILES notation for 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide?
The canonical SMILES for 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide is O=S(=O)(Cc1ccccc1)NCCOC1CCNCC1.
What is the InChIKey of 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide?
The InChIKey is AUQAJJPUPUGSHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S/c17-20(18,12-13-4-2-1-3-5-13)16-10-11-19-14-6-8-15-9-7-14/h1-5,14-16H,6-12H2.
What are the key properties of 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide?
1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide has a molecular weight of 298.41 g/mol, XLogP of 0.87, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(2-piperidin-4-yloxyethyl)methanesulfonamide is sourced from PubChem (CID 63871482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).