N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide

C13H27N3O2S — CID 102639398

IUPACN-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)N(C)C1CCCCC1N
InChIInChI=1S/C13H27N3O2S/c1-11-7-5-6-10-16(11)19(17,18)15(2)13-9-4-3-8-12(13)14/h11-13H,3-10,14H2,1-2H3
InChIKeyPNQKRGBXRFFIAR-UHFFFAOYSA-N
MW289.44 g/mol
LogP1.31
Rot. Bonds3

About N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide

N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide (PubChem CID 102639398) has the molecular formula C13H27N3O2S and a molecular weight of 289.44 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide
PubChem CID102639398
Molecular FormulaC13H27N3O2S
Molecular Weight289.44 g/mol
Exact Mass289.18
IUPAC NameN-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)N(C)C1CCCCC1N
InChIInChI=1S/C13H27N3O2S/c1-11-7-5-6-10-16(11)19(17,18)15(2)13-9-4-3-8-12(13)14/h11-13H,3-10,14H2,1-2H3
InChIKeyPNQKRGBXRFFIAR-UHFFFAOYSA-N
XLogP1.31
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.44
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide
CID 79121076
N-cyclohexyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128926642
N,2-dimethyl-N-piperidin-4-ylpiperidine-1-sulfonamide
CID 43606996
N,2-dimethyl-N-[4-(methylamino)cyclohexyl]piperidine-1-sulfonamide
CID 79123031
N,N,2-trimethylpyrrolidine-1-sulfonamide
CID 110728214
N-(2-hydroxyethyl)-N,2-dimethylpiperidine-1-sulfonamide
CID 60961271
(2S)-2-methylpiperidine-1-sulfonyl chloride
CID 98117610
N-butyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128927637
N'-hydroxy-3-[methyl-(2-methylpiperidin-1-yl)sulfonylamino]butanimidamide
CID 76987819
N-ethyl-N,2-dimethylpyrrolidine-1-sulfonamide
CID 130840821
N-(2-aminoethyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 61348368
(2R)-N,2-dimethyl-N-(pyridin-4-ylmethyl)piperidine-1-sulfonamide
CID 94812189

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide?
The IUPAC name of N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide (CID 102639398) is N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide.
What is the SMILES notation for N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide?
The canonical SMILES for N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)N(C)C1CCCCC1N.
What is the InChIKey of N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide?
The InChIKey is PNQKRGBXRFFIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2S/c1-11-7-5-6-10-16(11)19(17,18)15(2)13-9-4-3-8-12(13)14/h11-13H,3-10,14H2,1-2H3.
What are the key properties of N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide?
N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide has a molecular weight of 289.44 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 102639398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).