N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide

C11H23N3O2S — CID 59650061

IUPACN-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide
SMILESN[C@@H]1CCCC[C@H]1NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C11H23N3O2S/c12-10-6-2-3-7-11(10)13-17(15,16)14-8-4-1-5-9-14/h10-11,13H,1-9,12H2/t10-,11-/m1/s1
InChIKeyIAKJOLGEKLFJQZ-GHMZBOCLSA-N
MW261.39 g/mol
LogP0.58
Rot. Bonds3

About N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide

N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide (PubChem CID 59650061) has the molecular formula C11H23N3O2S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide
PubChem CID59650061
Molecular FormulaC11H23N3O2S
Molecular Weight261.39 g/mol
Exact Mass261.15
IUPAC NameN-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide
SMILESN[C@@H]1CCCC[C@H]1NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C11H23N3O2S/c12-10-6-2-3-7-11(10)13-17(15,16)14-8-4-1-5-9-14/h10-11,13H,1-9,12H2/t10-,11-/m1/s1
InChIKeyIAKJOLGEKLFJQZ-GHMZBOCLSA-N
XLogP0.58
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide?
The IUPAC name of N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide (CID 59650061) is N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide.
What is the SMILES notation for N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide?
The canonical SMILES for N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide is N[C@@H]1CCCC[C@H]1NS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide?
The InChIKey is IAKJOLGEKLFJQZ-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H23N3O2S/c12-10-6-2-3-7-11(10)13-17(15,16)14-8-4-1-5-9-14/h10-11,13H,1-9,12H2/t10-,11-/m1/s1.
What are the key properties of N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide?
N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide has a molecular weight of 261.39 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-aminocyclohexyl]piperidine-1-sulfonamide is sourced from PubChem (CID 59650061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).