N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide

C15H30N2O2S — CID 106016429

IUPACN-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide
SMILESO=S(=O)(CCC1CCNCC1)NCCCC1CCCC1
InChIInChI=1S/C15H30N2O2S/c18-20(19,13-9-15-7-11-16-12-8-15)17-10-3-6-14-4-1-2-5-14/h14-17H,1-13H2
InChIKeyLWFATMPNCZXWFR-UHFFFAOYSA-N
MW302.48 g/mol
LogP2.27
Rot. Bonds8

About N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide

N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide (PubChem CID 106016429) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide
PubChem CID106016429
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC NameN-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide
SMILESO=S(=O)(CCC1CCNCC1)NCCCC1CCCC1
InChIInChI=1S/C15H30N2O2S/c18-20(19,13-9-15-7-11-16-12-8-15)17-10-3-6-14-4-1-2-5-14/h14-17H,1-13H2
InChIKeyLWFATMPNCZXWFR-UHFFFAOYSA-N
XLogP2.27
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-piperidin-4-yl-N-(3-pyrrolidin-1-ylpropyl)ethanesulfonamide
CID 62992029
4-chloro-N-(3-cyclopentylpropyl)butane-1-sulfonamide
CID 105055639
N-(3-cyclopentylpropyl)-2-(ethylamino)ethanesulfonamide
CID 106013598
2-cyclopentyl-N-propylethanesulfonamide
CID 91196962
N-(3-cyclopentylpropyl)-1-piperidin-2-ylmethanesulfonamide
CID 106013597
N-[2-(4-hydroxyphenyl)ethyl]-2-piperidin-4-ylethanesulfonamide
CID 61236571
N-benzyl-2-piperidin-4-ylethanesulfonamide
CID 60890567
1-piperidin-4-yl-N-(3-pyrrolidin-1-ylpropyl)methanesulfonamide
CID 62989954
N-(2-methylbutyl)-2-piperidin-4-ylethanesulfonamide
CID 62691627
N-(2-cyclopentylethyl)propane-1-sulfonamide
CID 61383726
4-chloro-N-(3-cyclopropylpropyl)butane-1-sulfonamide
CID 116816598
4-(2-cyclopropylsulfonylethyl)piperidine
CID 84683146

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide?
The IUPAC name of N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide (CID 106016429) is N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide is O=S(=O)(CCC1CCNCC1)NCCCC1CCCC1.
What is the InChIKey of N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide?
The InChIKey is LWFATMPNCZXWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c18-20(19,13-9-15-7-11-16-12-8-15)17-10-3-6-14-4-1-2-5-14/h14-17H,1-13H2.
What are the key properties of N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide?
N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide has a molecular weight of 302.48 g/mol, XLogP of 2.27, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-2-piperidin-4-ylethanesulfonamide is sourced from PubChem (CID 106016429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).