4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine

C10H21NO3S — CID 155039129

IUPAC4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine
SMILESCOCC1CCN(CCS(C)(=O)=O)CC1
InChIInChI=1S/C10H21NO3S/c1-14-9-10-3-5-11(6-4-10)7-8-15(2,12)13/h10H,3-9H2,1-2H3
InChIKeyRVMMRSQVCWLNOF-UHFFFAOYSA-N
MW235.35 g/mol
LogP0.39
Rot. Bonds5

About 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine

4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine (PubChem CID 155039129) has the molecular formula C10H21NO3S and a molecular weight of 235.35 g/mol. Its IUPAC name is 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine.

Molecular Properties

Compound Name4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine
PubChem CID155039129
Molecular FormulaC10H21NO3S
Molecular Weight235.35 g/mol
Exact Mass235.12
IUPAC Name4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine
SMILESCOCC1CCN(CCS(C)(=O)=O)CC1
InChIInChI=1S/C10H21NO3S/c1-14-9-10-3-5-11(6-4-10)7-8-15(2,12)13/h10H,3-9H2,1-2H3
InChIKeyRVMMRSQVCWLNOF-UHFFFAOYSA-N
XLogP0.39
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Ethoxymethyl)-1-methylsulfonylpiperidine
CID 72015221
1-(Cyclopropylsulfonyl)-4-(methoxymethyl)piperidine
CID 71782917
2-[1-(2-methoxyethylsulfonyl)piperidin-4-yl]-N,N-dimethylethanamine
CID 84599871
4-(Isopropoxymethyl)-1-[2-(methylsulfonyl)ethyl]piperidine
CID 131947962
(1S)-1-[1-(2-methylsulfonylethyl)piperidin-4-yl]propan-1-ol
CID 164638196
1-Propylsulfonyl-4-(prop-2-ynoxymethyl)piperidine
CID 49670851
4-Methyl-1-(2-methylsulfonylethyl)piperidine
CID 20752926
4-Ethyl-1-(2-methylsulfonylethyl)piperidine
CID 53930711
4-(Methoxymethyl)-1-(methylsulfonyl)piperidine
CID 57580422
[1-(2-Methylsulfonylethyl)piperidin-4-yl]methanol
CID 57794920
1-Methyl-4-piperidinemethanol 4-methanesulfonate
CID 57810156
3-Methoxy-1-methyl-4-(methylsulfonylmethyl)piperidine
CID 58035214

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine?
The IUPAC name of 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine (CID 155039129) is 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine.
What is the SMILES notation for 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine?
The canonical SMILES for 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine is COCC1CCN(CCS(C)(=O)=O)CC1.
What is the InChIKey of 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine?
The InChIKey is RVMMRSQVCWLNOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3S/c1-14-9-10-3-5-11(6-4-10)7-8-15(2,12)13/h10H,3-9H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine?
4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine has a molecular weight of 235.35 g/mol, XLogP of 0.39, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-1-(2-methylsulfonylethyl)piperidine is sourced from PubChem (CID 155039129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).