2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride

C11H26ClN3O2S — CID 119984924

IUPAC2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)N1CCCC(C)C1CN.Cl
InChIInChI=1S/C11H25N3O2S.ClH/c1-4-13(5-2)17(15,16)14-8-6-7-10(3)11(14)9-12;/h10-11H,4-9,12H2,1-3H3;1H
InChIKeyULERXTRGIVSSHD-UHFFFAOYSA-N
MW299.87 g/mol
LogP1.05
Rot. Bonds5

About 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride

2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride (PubChem CID 119984924) has the molecular formula C11H26ClN3O2S and a molecular weight of 299.87 g/mol. Its IUPAC name is 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride
PubChem CID119984924
Molecular FormulaC11H26ClN3O2S
Molecular Weight299.87 g/mol
Exact Mass299.14
IUPAC Name2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)N1CCCC(C)C1CN.Cl
InChIInChI=1S/C11H25N3O2S.ClH/c1-4-13(5-2)17(15,16)14-8-6-7-10(3)11(14)9-12;/h10-11H,4-9,12H2,1-3H3;1H
InChIKeyULERXTRGIVSSHD-UHFFFAOYSA-N
XLogP1.05
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.87
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-methyl-1-(2-methylpiperidin-1-yl)sulfonylpiperidin-2-yl]methanamine;hydrochloride
CID 119984879
[(2R,3R)-1-(azepan-1-ylsulfonyl)-3-methylpiperidin-2-yl]methanamine
CID 124835693
2-(aminomethyl)-3-methyl-N-propylpiperidine-1-sulfonamide
CID 114810844
2-amino-N,N-diethylazepane-1-sulfonamide
CID 64560720
[3-methyl-1-(3,4,5-trifluorophenyl)sulfonylpiperidin-2-yl]methanamine
CID 119984944
[1-(1-ethylimidazol-4-yl)sulfonyl-3-methylpiperidin-2-yl]methanamine
CID 79372612
[1-(2,5-dimethylfuran-3-yl)sulfonyl-3-methylpiperidin-2-yl]methanamine;hydrochloride
CID 102553899
3-[2-(aminomethyl)-3-methylpiperidin-1-yl]sulfonylbenzenesulfonamide;hydrochloride
CID 119984868
[3-methyl-1-(oxolan-3-ylmethylsulfonyl)piperidin-2-yl]methanamine
CID 119984742
[(2S,3S)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]sulfonyl-3-methylpiperidin-2-yl]methanamine
CID 125145965
3-amino-N,N-diethylpiperidine-1-sulfonamide
CID 43210480
tert-butyl (2S)-1-(diethylsulfamoyl)pyrrolidine-2-carboxylate
CID 81005114

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride (CID 119984924) is 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride is CCN(CC)S(=O)(=O)N1CCCC(C)C1CN.Cl.
What is the InChIKey of 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride?
The InChIKey is ULERXTRGIVSSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S.ClH/c1-4-13(5-2)17(15,16)14-8-6-7-10(3)11(14)9-12;/h10-11H,4-9,12H2,1-3H3;1H.
What are the key properties of 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride?
2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride has a molecular weight of 299.87 g/mol, XLogP of 1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,N-diethyl-3-methylpiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119984924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).