1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride

C10H22Cl2N2 — CID 153353229

IUPAC1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride
SMILESCC1(N2CCCCC2)CCNC1.Cl.Cl
InChIInChI=1S/C10H20N2.2ClH/c1-10(5-6-11-9-10)12-7-3-2-4-8-12;;/h11H,2-9H2,1H3;2*1H
InChIKeyRJYVVNSENWMXFH-UHFFFAOYSA-N
MW241.21 g/mol
LogP2.07
Rot. Bonds1

About 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride

1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride (PubChem CID 153353229) has the molecular formula C10H22Cl2N2 and a molecular weight of 241.21 g/mol. Its IUPAC name is 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride.

Molecular Properties

Compound Name1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride
PubChem CID153353229
Molecular FormulaC10H22Cl2N2
Molecular Weight241.21 g/mol
Exact Mass240.12
IUPAC Name1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride
SMILESCC1(N2CCCCC2)CCNC1.Cl.Cl
InChIInChI=1S/C10H20N2.2ClH/c1-10(5-6-11-9-10)12-7-3-2-4-8-12;;/h11H,2-9H2,1H3;2*1H
InChIKeyRJYVVNSENWMXFH-UHFFFAOYSA-N
XLogP2.07
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.21
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride?
The IUPAC name of 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride (CID 153353229) is 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride.
What is the SMILES notation for 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride?
The canonical SMILES for 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride is CC1(N2CCCCC2)CCNC1.Cl.Cl.
What is the InChIKey of 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride?
The InChIKey is RJYVVNSENWMXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.2ClH/c1-10(5-6-11-9-10)12-7-3-2-4-8-12;;/h11H,2-9H2,1H3;2*1H.
What are the key properties of 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride?
1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride has a molecular weight of 241.21 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylpyrrolidin-3-yl)piperidine;dihydrochloride is sourced from PubChem (CID 153353229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).