(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride

C7H18ClN3O2S — CID 119031274

IUPAC(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)N1CCC[C@@H](N)C1.Cl
InChIInChI=1S/C7H17N3O2S.ClH/c1-9(2)13(11,12)10-5-3-4-7(8)6-10;/h7H,3-6,8H2,1-2H3;1H/t7-;/m1./s1
InChIKeyCGTIRAPEJOPAQL-OGFXRTJISA-N
MW243.76 g/mol
LogP-0.36
Rot. Bonds2

About (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride

(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride (PubChem CID 119031274) has the molecular formula C7H18ClN3O2S and a molecular weight of 243.76 g/mol. Its IUPAC name is (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride
PubChem CID119031274
Molecular FormulaC7H18ClN3O2S
Molecular Weight243.76 g/mol
Exact Mass243.08
IUPAC Name(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)N1CCC[C@@H](N)C1.Cl
InChIInChI=1S/C7H17N3O2S.ClH/c1-9(2)13(11,12)10-5-3-4-7(8)6-10;/h7H,3-6,8H2,1-2H3;1H/t7-;/m1./s1
InChIKeyCGTIRAPEJOPAQL-OGFXRTJISA-N
XLogP-0.36
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.76
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride (CID 119031274) is (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride is CN(C)S(=O)(=O)N1CCC[C@@H](N)C1.Cl.
What is the InChIKey of (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride?
The InChIKey is CGTIRAPEJOPAQL-OGFXRTJISA-N. The full InChI is InChI=1S/C7H17N3O2S.ClH/c1-9(2)13(11,12)10-5-3-4-7(8)6-10;/h7H,3-6,8H2,1-2H3;1H/t7-;/m1./s1.
What are the key properties of (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride?
(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride has a molecular weight of 243.76 g/mol, XLogP of -0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119031274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).