N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide

C10H22N2O3S — CID 60865631

IUPACN-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide
SMILESCOCCNS(=O)(=O)CCC1CCCCN1
InChIInChI=1S/C10H22N2O3S/c1-15-8-7-12-16(13,14)9-5-10-4-2-3-6-11-10/h10-12H,2-9H2,1H3
InChIKeyYJRJIZWIYMZYRM-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.08
Rot. Bonds7

About N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide

N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide (PubChem CID 60865631) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide
PubChem CID60865631
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide
SMILESCOCCNS(=O)(=O)CCC1CCCCN1
InChIInChI=1S/C10H22N2O3S/c1-15-8-7-12-16(13,14)9-5-10-4-2-3-6-11-10/h10-12H,2-9H2,1H3
InChIKeyYJRJIZWIYMZYRM-UHFFFAOYSA-N
XLogP0.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.08
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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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide?
The IUPAC name of N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide (CID 60865631) is N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide is COCCNS(=O)(=O)CCC1CCCCN1.
What is the InChIKey of N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide?
The InChIKey is YJRJIZWIYMZYRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-15-8-7-12-16(13,14)9-5-10-4-2-3-6-11-10/h10-12H,2-9H2,1H3.
What are the key properties of N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide?
N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.08, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-piperidin-2-ylethanesulfonamide is sourced from PubChem (CID 60865631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).