N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide

C13H26N2O3S — CID 63829038

IUPACN-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide
SMILESO=S(=O)(CC1CCCNC1)NCCOC1CCCC1
InChIInChI=1S/C13H26N2O3S/c16-19(17,11-12-4-3-7-14-10-12)15-8-9-18-13-5-1-2-6-13/h12-15H,1-11H2
InChIKeyZUSAJUHSPKWTDQ-UHFFFAOYSA-N
MW290.43 g/mol
LogP0.86
Rot. Bonds7

About N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide

N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide (PubChem CID 63829038) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide
PubChem CID63829038
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC NameN-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide
SMILESO=S(=O)(CC1CCCNC1)NCCOC1CCCC1
InChIInChI=1S/C13H26N2O3S/c16-19(17,11-12-4-3-7-14-10-12)15-8-9-18-13-5-1-2-6-13/h12-15H,1-11H2
InChIKeyZUSAJUHSPKWTDQ-UHFFFAOYSA-N
XLogP0.86
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 50.86
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-(cyclohexylmethyl)-1-piperidin-3-ylmethanesulfonamide
CID 54972626
N-pent-4-ynyl-1-piperidin-3-ylmethanesulfonamide
CID 106222713
3-(cyclopentyloxymethyl)piperidine
CID 24693389
N-[2-(furan-2-yl)ethyl]-1-piperidin-3-ylmethanesulfonamide
CID 54972407
1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide
CID 54972057
2-amino-N-(2-cyclohexyloxyethyl)ethanesulfonamide
CID 63827888
1-piperidin-3-yl-N-[2-(triazol-1-yl)ethyl]methanesulfonamide
CID 113413001
1-(oxolan-3-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide;hydrochloride
CID 119979197
N-(2-cyclopropylpropan-2-yl)-1-piperidin-3-ylmethanesulfonamide
CID 114111424
N-(2-piperidin-3-ylethyl)propane-1-sulfonamide
CID 60895183
N-[(1-methylsulfanylcyclobutyl)methyl]-1-piperidin-3-ylmethanesulfonamide
CID 114116779
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-1-piperidin-3-ylmethanesulfonamide
CID 55201911

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide?
The IUPAC name of N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide (CID 63829038) is N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide?
The canonical SMILES for N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide is O=S(=O)(CC1CCCNC1)NCCOC1CCCC1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide?
The InChIKey is ZUSAJUHSPKWTDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3S/c16-19(17,11-12-4-3-7-14-10-12)15-8-9-18-13-5-1-2-6-13/h12-15H,1-11H2.
What are the key properties of N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide?
N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide has a molecular weight of 290.43 g/mol, XLogP of 0.86, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide is sourced from PubChem (CID 63829038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).