N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride

C11H24Cl2N2O — CID 54594204

IUPACN-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride
SMILESCNC1CCN(CC2CCOC2)CC1.Cl.Cl
InChIInChI=1S/C11H22N2O.2ClH/c1-12-11-2-5-13(6-3-11)8-10-4-7-14-9-10;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyFLPYLCWGLZCIRT-UHFFFAOYSA-N
MW271.23 g/mol
LogP1.55
Rot. Bonds3

About N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride

N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride (PubChem CID 54594204) has the molecular formula C11H24Cl2N2O and a molecular weight of 271.23 g/mol. Its IUPAC name is N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride.

Molecular Properties

Compound NameN-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride
PubChem CID54594204
Molecular FormulaC11H24Cl2N2O
Molecular Weight271.23 g/mol
Exact Mass270.13
IUPAC NameN-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride
SMILESCNC1CCN(CC2CCOC2)CC1.Cl.Cl
InChIInChI=1S/C11H22N2O.2ClH/c1-12-11-2-5-13(6-3-11)8-10-4-7-14-9-10;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyFLPYLCWGLZCIRT-UHFFFAOYSA-N
XLogP1.55
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.23
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride?
The IUPAC name of N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride (CID 54594204) is N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride.
What is the SMILES notation for N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride?
The canonical SMILES for N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride is CNC1CCN(CC2CCOC2)CC1.Cl.Cl.
What is the InChIKey of N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride?
The InChIKey is FLPYLCWGLZCIRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O.2ClH/c1-12-11-2-5-13(6-3-11)8-10-4-7-14-9-10;;/h10-12H,2-9H2,1H3;2*1H.
What are the key properties of N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride?
N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride has a molecular weight of 271.23 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine;dihydrochloride is sourced from PubChem (CID 54594204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).