4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride

C9H22ClN3O2S — CID 119963738

IUPAC4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCCN(C)S(=O)(=O)N1CCC(CN)CC1.Cl
InChIInChI=1S/C9H21N3O2S.ClH/c1-3-11(2)15(13,14)12-6-4-9(8-10)5-7-12;/h9H,3-8,10H2,1-2H3;1H
InChIKeySVJWSLJLAHETEV-UHFFFAOYSA-N
MW271.81 g/mol
LogP0.28
Rot. Bonds4

About 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride

4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride (PubChem CID 119963738) has the molecular formula C9H22ClN3O2S and a molecular weight of 271.81 g/mol. Its IUPAC name is 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
PubChem CID119963738
Molecular FormulaC9H22ClN3O2S
Molecular Weight271.81 g/mol
Exact Mass271.11
IUPAC Name4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCCN(C)S(=O)(=O)N1CCC(CN)CC1.Cl
InChIInChI=1S/C9H21N3O2S.ClH/c1-3-11(2)15(13,14)12-6-4-9(8-10)5-7-12;/h9H,3-8,10H2,1-2H3;1H
InChIKeySVJWSLJLAHETEV-UHFFFAOYSA-N
XLogP0.28
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.81
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-ethylsulfonylpiperidin-4-yl)methanamine
CID 28706827
N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride
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N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide
CID 119977585
4-amino-N-methyl-N-propylpiperidine-1-sulfonamide
CID 119958974
4-(aminomethyl)-N-(2-methylpropyl)-N-pentan-3-ylpiperidine-1-sulfonamide
CID 79488387
4-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)piperidine-1-sulfonamide
CID 79487831
N-ethyl-N-methylthiomorpholine-4-sulfonamide
CID 58831796
[1-(cyclopropylmethylsulfonyl)piperidin-4-yl]methanamine;hydrochloride
CID 119998739
3-(aminomethyl)-N-cyclohexyl-N-methylpyrrolidine-1-sulfonamide;hydrochloride
CID 119971798
3-amino-N-methyl-N-propylpyrrolidine-1-sulfonamide;hydrochloride
CID 119971553
(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)methanamine
CID 43605338
[1-(difluoromethylsulfonyl)piperidin-4-yl]methanamine;hydrochloride
CID 54592998

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride (CID 119963738) is 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride is CCN(C)S(=O)(=O)N1CCC(CN)CC1.Cl.
What is the InChIKey of 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
The InChIKey is SVJWSLJLAHETEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S.ClH/c1-3-11(2)15(13,14)12-6-4-9(8-10)5-7-12;/h9H,3-8,10H2,1-2H3;1H.
What are the key properties of 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride?
4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride has a molecular weight of 271.81 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119963738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).