3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide

C10H22N2O3S — CID 110610365

IUPAC3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide
SMILESCCNS(=O)(=O)N1CCCC(COCC)C1
InChIInChI=1S/C10H22N2O3S/c1-3-11-16(13,14)12-7-5-6-10(8-12)9-15-4-2/h10-11H,3-9H2,1-2H3
InChIKeyVBMSCIBNCWLDPG-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.59
Rot. Bonds6

About 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide

3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide (PubChem CID 110610365) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide
PubChem CID110610365
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide
SMILESCCNS(=O)(=O)N1CCCC(COCC)C1
InChIInChI=1S/C10H22N2O3S/c1-3-11-16(13,14)12-7-5-6-10(8-12)9-15-4-2/h10-11H,3-9H2,1-2H3
InChIKeyVBMSCIBNCWLDPG-UHFFFAOYSA-N
XLogP0.59
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-3-(ethoxymethyl)piperidine-1-sulfonamide
CID 110610368
(3S)-3-(ethoxymethyl)-1-(3-methyltriazol-4-yl)sulfonylpiperidine
CID 164639150
N-(1-ethoxypropan-2-yl)-3-(ethylaminomethyl)piperidine-1-sulfonamide
CID 106054302
1-(3,4-dimethylphenyl)sulfonyl-3-(ethoxymethyl)piperidine
CID 110602793
1-(2-chlorophenyl)sulfonyl-3-(ethoxymethyl)piperidine
CID 110418188
3-(ethoxymethyl)-1-(3-methylphenyl)sulfonylpiperidine
CID 110418161
3-(ethoxymethyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine
CID 110602803
3-(2-aminoethyl)-N-ethylpyrrolidine-1-sulfonamide
CID 114813055
N-ethylazepane-1-sulfonamide
CID 43213421
3-(ethoxymethyl)-1-ethylpiperidine
CID 91434061
3-(aminomethyl)-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-1-sulfonamide
CID 106053544
N-[[1-(2-ethoxyethylsulfonyl)piperidin-3-yl]methyl]ethanamine
CID 55258778

Frequently Asked Questions

What is the IUPAC name of 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide?
The IUPAC name of 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide (CID 110610365) is 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide.
What is the SMILES notation for 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide?
The canonical SMILES for 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide is CCNS(=O)(=O)N1CCCC(COCC)C1.
What is the InChIKey of 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide?
The InChIKey is VBMSCIBNCWLDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-3-11-16(13,14)12-7-5-6-10(8-12)9-15-4-2/h10-11H,3-9H2,1-2H3.
What are the key properties of 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide?
3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide is sourced from PubChem (CID 110610365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).