(2R,6S)-2,6-dimethylpiperidine;hydrochloride

C7H16ClN — CID 6420071

IUPAC(2R,6S)-2,6-dimethylpiperidine;hydrochloride
SMILESC[C@@H]1CCC[C@H](C)N1.Cl
InChIInChI=1S/C7H15N.ClH/c1-6-4-3-5-7(2)8-6;/h6-8H,3-5H2,1-2H3;1H/t6-,7+;
InChIKeyPEDXCVQZZVVOGO-UKMDXRBESA-N
MW149.66 g/mol
LogP1.96
Rot. Bonds

About (2R,6S)-2,6-dimethylpiperidine;hydrochloride

(2R,6S)-2,6-dimethylpiperidine;hydrochloride (PubChem CID 6420071) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is (2R,6S)-2,6-dimethylpiperidine;hydrochloride.

Molecular Properties

Compound Name(2R,6S)-2,6-dimethylpiperidine;hydrochloride
PubChem CID6420071
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Name(2R,6S)-2,6-dimethylpiperidine;hydrochloride
SMILESC[C@@H]1CCC[C@H](C)N1.Cl
InChIInChI=1S/C7H15N.ClH/c1-6-4-3-5-7(2)8-6;/h6-8H,3-5H2,1-2H3;1H/t6-,7+;
InChIKeyPEDXCVQZZVVOGO-UKMDXRBESA-N
XLogP1.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.66
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R,6S)-2,6-dimethylpiperidine;hydrochloride?
The IUPAC name of (2R,6S)-2,6-dimethylpiperidine;hydrochloride (CID 6420071) is (2R,6S)-2,6-dimethylpiperidine;hydrochloride.
What is the SMILES notation for (2R,6S)-2,6-dimethylpiperidine;hydrochloride?
The canonical SMILES for (2R,6S)-2,6-dimethylpiperidine;hydrochloride is C[C@@H]1CCC[C@H](C)N1.Cl.
What is the InChIKey of (2R,6S)-2,6-dimethylpiperidine;hydrochloride?
The InChIKey is PEDXCVQZZVVOGO-UKMDXRBESA-N. The full InChI is InChI=1S/C7H15N.ClH/c1-6-4-3-5-7(2)8-6;/h6-8H,3-5H2,1-2H3;1H/t6-,7+;.
What are the key properties of (2R,6S)-2,6-dimethylpiperidine;hydrochloride?
(2R,6S)-2,6-dimethylpiperidine;hydrochloride has a molecular weight of 149.66 g/mol, XLogP of 1.96, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-2,6-dimethylpiperidine;hydrochloride is sourced from PubChem (CID 6420071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).