N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide

C12H27N3O2S — CID 62007444

IUPACN-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide
SMILESCCN(C(C)(C)CN)S(=O)(=O)N1CCCCC1C
InChIInChI=1S/C12H27N3O2S/c1-5-15(12(3,4)10-13)18(16,17)14-9-7-6-8-11(14)2/h11H,5-10,13H2,1-4H3
InChIKeyJXUBZSVIGZMSRG-UHFFFAOYSA-N
MW277.43 g/mol
LogP1.16
Rot. Bonds5

About N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide

N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide (PubChem CID 62007444) has the molecular formula C12H27N3O2S and a molecular weight of 277.43 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide
PubChem CID62007444
Molecular FormulaC12H27N3O2S
Molecular Weight277.43 g/mol
Exact Mass277.18
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide
SMILESCCN(C(C)(C)CN)S(=O)(=O)N1CCCCC1C
InChIInChI=1S/C12H27N3O2S/c1-5-15(12(3,4)10-13)18(16,17)14-9-7-6-8-11(14)2/h11H,5-10,13H2,1-4H3
InChIKeyJXUBZSVIGZMSRG-UHFFFAOYSA-N
XLogP1.16
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.43
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N,2-dimethylpyrrolidine-1-sulfonamide
CID 130840821
N-(2-aminoethyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 61348368
3-[ethyl-(2-methylpiperidin-1-yl)sulfonylamino]-N'-hydroxypropanimidamide
CID 54992516
N-(1-amino-2-methylpropan-2-yl)-N-ethylcyclopropanesulfonamide
CID 64552380
N-butyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128927637
N-(3-aminopropyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 43136957
N-(3-aminopropyl)-N-cyclopropyl-2-methylpiperidine-1-sulfonamide
CID 43136981
N'-hydroxy-3-[methyl-(2-methylpiperidin-1-yl)sulfonylamino]butanimidamide
CID 76987819
N-(1-amino-2-methylpropan-2-yl)-N-propylpyrrolidine-1-sulfonamide
CID 62007446
(2R)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 95301386
(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 95301387
N-cyclohexyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128926642

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide (CID 62007444) is N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide is CCN(C(C)(C)CN)S(=O)(=O)N1CCCCC1C.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide?
The InChIKey is JXUBZSVIGZMSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2S/c1-5-15(12(3,4)10-13)18(16,17)14-9-7-6-8-11(14)2/h11H,5-10,13H2,1-4H3.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide?
N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide has a molecular weight of 277.43 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-N-ethyl-2-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 62007444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).