1,2,6-trimethylpiperidine;hydrochloride

C8H18ClN — CID 12698396

IUPAC1,2,6-trimethylpiperidine;hydrochloride
SMILESCC1CCCC(C)N1C.Cl
InChIInChI=1S/C8H17N.ClH/c1-7-5-4-6-8(2)9(7)3;/h7-8H,4-6H2,1-3H3;1H
InChIKeySGHOQRXVBBZEPM-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.30
Rot. Bonds

About 1,2,6-trimethylpiperidine;hydrochloride

1,2,6-trimethylpiperidine;hydrochloride (PubChem CID 12698396) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is 1,2,6-trimethylpiperidine;hydrochloride.

Molecular Properties

Compound Name1,2,6-trimethylpiperidine;hydrochloride
PubChem CID12698396
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC Name1,2,6-trimethylpiperidine;hydrochloride
SMILESCC1CCCC(C)N1C.Cl
InChIInChI=1S/C8H17N.ClH/c1-7-5-4-6-8(2)9(7)3;/h7-8H,4-6H2,1-3H3;1H
InChIKeySGHOQRXVBBZEPM-UHFFFAOYSA-N
XLogP2.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Cyclohexylpiperidine
CID 18724
Methylconiine
CID 169683
1,2,6-Trimethylpiperidine
CID 107328
1,2-Dimethylpiperidine
CID 12637
Piperidine, 1-cyclohexyl-, hydrochloride
CID 201010
N-Isopropylpiperidine
CID 240410
1-Ethyl-1-heptylpiperidinium bromide
CID 211625
Piperidinium, 1,1-diethyl-2,6-dimethyl-, bromide
CID 86823
Piperidine, 1-propyl-, hydrochloride
CID 205379
Tropane, hydrochloride
CID 211741
1-Butyl-1-methylpiperidinium chloride
CID 57519175
1-Methyl-2-propylpiperidine
CID 338921

Frequently Asked Questions

What is the IUPAC name of 1,2,6-trimethylpiperidine;hydrochloride?
The IUPAC name of 1,2,6-trimethylpiperidine;hydrochloride (CID 12698396) is 1,2,6-trimethylpiperidine;hydrochloride.
What is the SMILES notation for 1,2,6-trimethylpiperidine;hydrochloride?
The canonical SMILES for 1,2,6-trimethylpiperidine;hydrochloride is CC1CCCC(C)N1C.Cl.
What is the InChIKey of 1,2,6-trimethylpiperidine;hydrochloride?
The InChIKey is SGHOQRXVBBZEPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-7-5-4-6-8(2)9(7)3;/h7-8H,4-6H2,1-3H3;1H.
What are the key properties of 1,2,6-trimethylpiperidine;hydrochloride?
1,2,6-trimethylpiperidine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,6-trimethylpiperidine;hydrochloride is sourced from PubChem (CID 12698396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).