2-(2-methylpropyl)piperidine;hydrochloride

C9H20ClN — CID 17389625

IUPAC2-(2-methylpropyl)piperidine;hydrochloride
SMILESCC(C)CC1CCCCN1.Cl
InChIInChI=1S/C9H19N.ClH/c1-8(2)7-9-5-3-4-6-10-9;/h8-10H,3-7H2,1-2H3;1H
InChIKeyIJMUKVRHBBHNOX-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.60
Rot. Bonds2

About 2-(2-methylpropyl)piperidine;hydrochloride

2-(2-methylpropyl)piperidine;hydrochloride (PubChem CID 17389625) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is 2-(2-methylpropyl)piperidine;hydrochloride.

Molecular Properties

Compound Name2-(2-methylpropyl)piperidine;hydrochloride
PubChem CID17389625
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC Name2-(2-methylpropyl)piperidine;hydrochloride
SMILESCC(C)CC1CCCCN1.Cl
InChIInChI=1S/C9H19N.ClH/c1-8(2)7-9-5-3-4-6-10-9;/h8-10H,3-7H2,1-2H3;1H
InChIKeyIJMUKVRHBBHNOX-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.72
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)piperidine;hydrochloride?
The IUPAC name of 2-(2-methylpropyl)piperidine;hydrochloride (CID 17389625) is 2-(2-methylpropyl)piperidine;hydrochloride.
What is the SMILES notation for 2-(2-methylpropyl)piperidine;hydrochloride?
The canonical SMILES for 2-(2-methylpropyl)piperidine;hydrochloride is CC(C)CC1CCCCN1.Cl.
What is the InChIKey of 2-(2-methylpropyl)piperidine;hydrochloride?
The InChIKey is IJMUKVRHBBHNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-8(2)7-9-5-3-4-6-10-9;/h8-10H,3-7H2,1-2H3;1H.
What are the key properties of 2-(2-methylpropyl)piperidine;hydrochloride?
2-(2-methylpropyl)piperidine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)piperidine;hydrochloride is sourced from PubChem (CID 17389625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).