N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine

C14H30N2O2S — CID 115900651

IUPACN-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCCS(=O)(=O)CC(C)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H30N2O2S/c1-7-19(17,18)10-11(2)15-12-8-13(3,4)16-14(5,6)9-12/h11-12,15-16H,7-10H2,1-6H3
InChIKeyFELFHGQJBAMLKO-UHFFFAOYSA-N
MW290.47 g/mol
LogP1.71
Rot. Bonds5

About N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine

N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine (PubChem CID 115900651) has the molecular formula C14H30N2O2S and a molecular weight of 290.47 g/mol. Its IUPAC name is N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine
PubChem CID115900651
Molecular FormulaC14H30N2O2S
Molecular Weight290.47 g/mol
Exact Mass290.20
IUPAC NameN-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCCS(=O)(=O)CC(C)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H30N2O2S/c1-7-19(17,18)10-11(2)15-12-8-13(3,4)16-14(5,6)9-12/h11-12,15-16H,7-10H2,1-6H3
InChIKeyFELFHGQJBAMLKO-UHFFFAOYSA-N
XLogP1.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.47
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-(Methylsulfonyl)ethyl)piperidine
CID 53485993
N-(1-ethylsulfonylpropan-2-yl)-1-propan-2-ylpiperidin-4-amine
CID 86811497
N-[(3-fluoropiperidin-3-yl)methyl]-1,1-dioxothiolan-3-amine
CID 105509019
N-[(3-fluoropiperidin-3-yl)methyl]-1,1-dioxothian-3-amine
CID 105515166
N-[(3-fluoropiperidin-3-yl)methyl]-1,1-dioxothian-4-amine
CID 105515167
2-(4-Tert-butylsulfonyl-2-fluoro-2-methylbutyl)piperidine
CID 106735976
2-(4-Ethylsulfonyl-2-fluoro-2-methylbutyl)piperidine
CID 106735977
3-(3-Ethylsulfonylpropyl)-3-fluoropiperidine
CID 112562975
2-(5-Ethylsulfonyl-2-fluoro-2-methylpentyl)piperidine
CID 113462317
2-(2-Fluoro-2-methyl-5-methylsulfonylpentyl)piperidine
CID 113462350
2-(2-Fluoro-2-methyl-4-propylsulfonylbutyl)piperidine
CID 113871352
2-(2-Fluoro-2-methyl-4-propan-2-ylsulfonylbutyl)piperidine
CID 113871353

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine?
The IUPAC name of N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine (CID 115900651) is N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine.
What is the SMILES notation for N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine?
The canonical SMILES for N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine is CCS(=O)(=O)CC(C)NC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine?
The InChIKey is FELFHGQJBAMLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2S/c1-7-19(17,18)10-11(2)15-12-8-13(3,4)16-14(5,6)9-12/h11-12,15-16H,7-10H2,1-6H3.
What are the key properties of N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine?
N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine has a molecular weight of 290.47 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylsulfonylpropan-2-yl)-2,2,6,6-tetramethylpiperidin-4-amine is sourced from PubChem (CID 115900651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).