4-propylpiperidine;hydrochloride

C8H18ClN — CID 44558455

IUPAC4-propylpiperidine;hydrochloride
SMILESCCCC1CCNCC1.Cl
InChIInChI=1S/C8H17N.ClH/c1-2-3-8-4-6-9-7-5-8;/h8-9H,2-7H2,1H3;1H
InChIKeyJVGBCLPGZDHAFF-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.21
Rot. Bonds2

About 4-propylpiperidine;hydrochloride

4-propylpiperidine;hydrochloride (PubChem CID 44558455) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is 4-propylpiperidine;hydrochloride.

Molecular Properties

Compound Name4-propylpiperidine;hydrochloride
PubChem CID44558455
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC Name4-propylpiperidine;hydrochloride
SMILESCCCC1CCNCC1.Cl
InChIInChI=1S/C8H17N.ClH/c1-2-3-8-4-6-9-7-5-8;/h8-9H,2-7H2,1H3;1H
InChIKeyJVGBCLPGZDHAFF-UHFFFAOYSA-N
XLogP2.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-propylpiperidine;hydrochloride?
The IUPAC name of 4-propylpiperidine;hydrochloride (CID 44558455) is 4-propylpiperidine;hydrochloride.
What is the SMILES notation for 4-propylpiperidine;hydrochloride?
The canonical SMILES for 4-propylpiperidine;hydrochloride is CCCC1CCNCC1.Cl.
What is the InChIKey of 4-propylpiperidine;hydrochloride?
The InChIKey is JVGBCLPGZDHAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-2-3-8-4-6-9-7-5-8;/h8-9H,2-7H2,1H3;1H.
What are the key properties of 4-propylpiperidine;hydrochloride?
4-propylpiperidine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propylpiperidine;hydrochloride is sourced from PubChem (CID 44558455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).