N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide

C15H30N2O2S — CID 55571821

IUPACN-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide
SMILESCC1CC(C)CN(S(=O)(=O)NCCCC2CCCC2)C1
InChIInChI=1S/C15H30N2O2S/c1-13-10-14(2)12-17(11-13)20(18,19)16-9-5-8-15-6-3-4-7-15/h13-16H,3-12H2,1-2H3
InChIKeyXAGFVZRFBQSMRD-UHFFFAOYSA-N
MW302.48 g/mol
LogP2.77
Rot. Bonds6

About N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide

N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide (PubChem CID 55571821) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide
PubChem CID55571821
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC NameN-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide
SMILESCC1CC(C)CN(S(=O)(=O)NCCCC2CCCC2)C1
InChIInChI=1S/C15H30N2O2S/c1-13-10-14(2)12-17(11-13)20(18,19)16-9-5-8-15-6-3-4-7-15/h13-16H,3-12H2,1-2H3
InChIKeyXAGFVZRFBQSMRD-UHFFFAOYSA-N
XLogP2.77
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,5-dimethyl-N-propylpiperidine-1-sulfonamide
CID 43243297
N-(2-aminoethyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 43603509
N-[2-(cyclopropylamino)ethyl]-3,5-dimethylpiperidine-1-sulfonamide
CID 62665167
3,5-dimethyl-N-[2-(methylamino)ethyl]piperidine-1-sulfonamide;hydrochloride
CID 119973056
(3S,5R)-3,5-dimethyl-N-[2-[(1S,2S)-2-methylcyclohexyl]oxyethyl]piperidine-1-sulfonamide
CID 52530156
3-methyl-N-[2-[(3-methylpiperidin-1-yl)sulfonylamino]ethyl]piperidine-1-sulfonamide
CID 46595803
N-(3-cyclopentylpropyl)-2-(hydroxymethyl)piperidine-1-sulfonamide
CID 106014558
N-(6-bromohexyl)-3-methylpiperidine-1-sulfonamide
CID 107848876
3-amino-5-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 114816194
3,5-dimethyl-N-(3,3,3-trifluoro-2-hydroxypropyl)piperidine-1-sulfonamide
CID 103834061
2-[[(3,5-dimethylpiperidin-1-yl)sulfonylamino]methyl]-3-methylbutanoic acid
CID 65221418
N-(3-cyclopentylpropyl)-2-(ethylamino)ethanesulfonamide
CID 106013598

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide?
The IUPAC name of N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide (CID 55571821) is N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide is CC1CC(C)CN(S(=O)(=O)NCCCC2CCCC2)C1.
What is the InChIKey of N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide?
The InChIKey is XAGFVZRFBQSMRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c1-13-10-14(2)12-17(11-13)20(18,19)16-9-5-8-15-6-3-4-7-15/h13-16H,3-12H2,1-2H3.
What are the key properties of N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide?
N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide has a molecular weight of 302.48 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-3,5-dimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 55571821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).