4-methyl-4-(2-methylpropyl)piperidine;hydrochloride

C10H22ClN — CID 119031504

IUPAC4-methyl-4-(2-methylpropyl)piperidine;hydrochloride
SMILESCC(C)CC1(C)CCNCC1.Cl
InChIInChI=1S/C10H21N.ClH/c1-9(2)8-10(3)4-6-11-7-5-10;/h9,11H,4-8H2,1-3H3;1H
InChIKeyLHJHKFSPECCPEO-UHFFFAOYSA-N
MW191.75 g/mol
LogP2.84
Rot. Bonds2

About 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride

4-methyl-4-(2-methylpropyl)piperidine;hydrochloride (PubChem CID 119031504) has the molecular formula C10H22ClN and a molecular weight of 191.75 g/mol. Its IUPAC name is 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride.

Molecular Properties

Compound Name4-methyl-4-(2-methylpropyl)piperidine;hydrochloride
PubChem CID119031504
Molecular FormulaC10H22ClN
Molecular Weight191.75 g/mol
Exact Mass191.14
IUPAC Name4-methyl-4-(2-methylpropyl)piperidine;hydrochloride
SMILESCC(C)CC1(C)CCNCC1.Cl
InChIInChI=1S/C10H21N.ClH/c1-9(2)8-10(3)4-6-11-7-5-10;/h9,11H,4-8H2,1-3H3;1H
InChIKeyLHJHKFSPECCPEO-UHFFFAOYSA-N
XLogP2.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.75
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride?
The IUPAC name of 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride (CID 119031504) is 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride.
What is the SMILES notation for 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride?
The canonical SMILES for 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride is CC(C)CC1(C)CCNCC1.Cl.
What is the InChIKey of 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride?
The InChIKey is LHJHKFSPECCPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N.ClH/c1-9(2)8-10(3)4-6-11-7-5-10;/h9,11H,4-8H2,1-3H3;1H.
What are the key properties of 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride?
4-methyl-4-(2-methylpropyl)piperidine;hydrochloride has a molecular weight of 191.75 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-(2-methylpropyl)piperidine;hydrochloride is sourced from PubChem (CID 119031504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).