2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride

C10H24ClN3O2S — CID 119965247

IUPAC2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCCN(C)S(=O)(=O)N1CCCCC1C(C)N.Cl
InChIInChI=1S/C10H23N3O2S.ClH/c1-4-12(3)16(14,15)13-8-6-5-7-10(13)9(2)11;/h9-10H,4-8,11H2,1-3H3;1H
InChIKeyBTFOXLDTOCHZDN-UHFFFAOYSA-N
MW285.84 g/mol
LogP0.81
Rot. Bonds4

About 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride

2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride (PubChem CID 119965247) has the molecular formula C10H24ClN3O2S and a molecular weight of 285.84 g/mol. Its IUPAC name is 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
PubChem CID119965247
Molecular FormulaC10H24ClN3O2S
Molecular Weight285.84 g/mol
Exact Mass285.13
IUPAC Name2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCCN(C)S(=O)(=O)N1CCCCC1C(C)N.Cl
InChIInChI=1S/C10H23N3O2S.ClH/c1-4-12(3)16(14,15)13-8-6-5-7-10(13)9(2)11;/h9-10H,4-8,11H2,1-3H3;1H
InChIKeyBTFOXLDTOCHZDN-UHFFFAOYSA-N
XLogP0.81
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.84
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N,2-dimethylpyrrolidine-1-sulfonamide
CID 130840821
1-[1-(2-methylpiperidin-1-yl)sulfonylpiperidin-2-yl]ethanamine;hydrochloride
CID 119965380
methyl 2-[2-(1-aminoethyl)piperidin-1-yl]sulfonylacetate
CID 55169536
1-[1-(3-fluoro-5-methylphenyl)sulfonylpiperidin-2-yl]ethanamine;hydrochloride
CID 119965497
1-[1-(oxan-3-ylsulfonyl)piperidin-2-yl]ethanamine;hydrochloride
CID 120999650
1-[1-(1,1-dioxothian-4-yl)sulfonylpiperidin-2-yl]ethanamine
CID 63255342
1-[1-(4-propylphenyl)sulfonylpiperidin-2-yl]ethanamine
CID 63255131
5-[2-(1-aminoethyl)piperidin-1-yl]sulfonyl-N,N,2-trimethylaniline;hydrochloride
CID 119965410
N-butyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128927637
3-amino-N-[[1-[ethyl(methyl)sulfamoyl]piperidin-2-yl]methyl]propanamide
CID 120584445
1-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidin-2-yl]ethanamine
CID 63255037
1-[1-[4-(2-ethoxyethoxy)phenyl]sulfonylpiperidin-2-yl]ethanamine;hydrochloride
CID 119965481

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride (CID 119965247) is 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride is CCN(C)S(=O)(=O)N1CCCCC1C(C)N.Cl.
What is the InChIKey of 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
The InChIKey is BTFOXLDTOCHZDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S.ClH/c1-4-12(3)16(14,15)13-8-6-5-7-10(13)9(2)11;/h9-10H,4-8,11H2,1-3H3;1H.
What are the key properties of 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride has a molecular weight of 285.84 g/mol, XLogP of 0.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminoethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119965247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).