4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride

C10H22Cl2N2 — CID 23153021

IUPAC4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride
SMILESC1CCN(CC2CCNCC2)C1.Cl.Cl
InChIInChI=1S/C10H20N2.2ClH/c1-2-8-12(7-1)9-10-3-5-11-6-4-10;;/h10-11H,1-9H2;2*1H
InChIKeyNOSKZLBNQLEUKE-UHFFFAOYSA-N
MW241.21 g/mol
LogP1.93
Rot. Bonds2

About 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride

4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride (PubChem CID 23153021) has the molecular formula C10H22Cl2N2 and a molecular weight of 241.21 g/mol. Its IUPAC name is 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride.

Molecular Properties

Compound Name4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride
PubChem CID23153021
Molecular FormulaC10H22Cl2N2
Molecular Weight241.21 g/mol
Exact Mass240.12
IUPAC Name4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride
SMILESC1CCN(CC2CCNCC2)C1.Cl.Cl
InChIInChI=1S/C10H20N2.2ClH/c1-2-8-12(7-1)9-10-3-5-11-6-4-10;;/h10-11H,1-9H2;2*1H
InChIKeyNOSKZLBNQLEUKE-UHFFFAOYSA-N
XLogP1.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.21
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride?
The IUPAC name of 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride (CID 23153021) is 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride.
What is the SMILES notation for 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride?
The canonical SMILES for 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride is C1CCN(CC2CCNCC2)C1.Cl.Cl.
What is the InChIKey of 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride?
The InChIKey is NOSKZLBNQLEUKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.2ClH/c1-2-8-12(7-1)9-10-3-5-11-6-4-10;;/h10-11H,1-9H2;2*1H.
What are the key properties of 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride?
4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride has a molecular weight of 241.21 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyrrolidin-1-ylmethyl)piperidine;dihydrochloride is sourced from PubChem (CID 23153021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).