4-(2-methylpropoxymethyl)piperidine;hydrochloride

C10H22ClNO — CID 43810754

IUPAC4-(2-methylpropoxymethyl)piperidine;hydrochloride
SMILESCC(C)COCC1CCNCC1.Cl
InChIInChI=1S/C10H21NO.ClH/c1-9(2)7-12-8-10-3-5-11-6-4-10;/h9-11H,3-8H2,1-2H3;1H
InChIKeyNUBQTNJBIMTTOS-UHFFFAOYSA-N
MW207.74 g/mol
LogP2.08
Rot. Bonds4

About 4-(2-methylpropoxymethyl)piperidine;hydrochloride

4-(2-methylpropoxymethyl)piperidine;hydrochloride (PubChem CID 43810754) has the molecular formula C10H22ClNO and a molecular weight of 207.74 g/mol. Its IUPAC name is 4-(2-methylpropoxymethyl)piperidine;hydrochloride.

Molecular Properties

Compound Name4-(2-methylpropoxymethyl)piperidine;hydrochloride
PubChem CID43810754
Molecular FormulaC10H22ClNO
Molecular Weight207.74 g/mol
Exact Mass207.14
IUPAC Name4-(2-methylpropoxymethyl)piperidine;hydrochloride
SMILESCC(C)COCC1CCNCC1.Cl
InChIInChI=1S/C10H21NO.ClH/c1-9(2)7-12-8-10-3-5-11-6-4-10;/h9-11H,3-8H2,1-2H3;1H
InChIKeyNUBQTNJBIMTTOS-UHFFFAOYSA-N
XLogP2.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.74
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropoxymethyl)piperidine;hydrochloride?
The IUPAC name of 4-(2-methylpropoxymethyl)piperidine;hydrochloride (CID 43810754) is 4-(2-methylpropoxymethyl)piperidine;hydrochloride.
What is the SMILES notation for 4-(2-methylpropoxymethyl)piperidine;hydrochloride?
The canonical SMILES for 4-(2-methylpropoxymethyl)piperidine;hydrochloride is CC(C)COCC1CCNCC1.Cl.
What is the InChIKey of 4-(2-methylpropoxymethyl)piperidine;hydrochloride?
The InChIKey is NUBQTNJBIMTTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.ClH/c1-9(2)7-12-8-10-3-5-11-6-4-10;/h9-11H,3-8H2,1-2H3;1H.
What are the key properties of 4-(2-methylpropoxymethyl)piperidine;hydrochloride?
4-(2-methylpropoxymethyl)piperidine;hydrochloride has a molecular weight of 207.74 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropoxymethyl)piperidine;hydrochloride is sourced from PubChem (CID 43810754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).