1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride

C11H26Cl3N3O — CID 47002949

IUPAC1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride
SMILESCl.Cl.Cl.NC1CCN(CCN2CCOCC2)CC1
InChIInChI=1S/C11H23N3O.3ClH/c12-11-1-3-13(4-2-11)5-6-14-7-9-15-10-8-14;;;/h11H,1-10,12H2;3*1H
InChIKeyYENHEZHJLRKQKA-UHFFFAOYSA-N
MW322.71 g/mol
LogP1.01
Rot. Bonds3

About 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride

1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride (PubChem CID 47002949) has the molecular formula C11H26Cl3N3O and a molecular weight of 322.71 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride
PubChem CID47002949
Molecular FormulaC11H26Cl3N3O
Molecular Weight322.71 g/mol
Exact Mass321.11
IUPAC Name1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride
SMILESCl.Cl.Cl.NC1CCN(CCN2CCOCC2)CC1
InChIInChI=1S/C11H23N3O.3ClH/c12-11-1-3-13(4-2-11)5-6-14-7-9-15-10-8-14;;;/h11H,1-10,12H2;3*1H
InChIKeyYENHEZHJLRKQKA-UHFFFAOYSA-N
XLogP1.01
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.71
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride?
The IUPAC name of 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride (CID 47002949) is 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride is Cl.Cl.Cl.NC1CCN(CCN2CCOCC2)CC1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride?
The InChIKey is YENHEZHJLRKQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O.3ClH/c12-11-1-3-13(4-2-11)5-6-14-7-9-15-10-8-14;;;/h11H,1-10,12H2;3*1H.
What are the key properties of 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride?
1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride has a molecular weight of 322.71 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)piperidin-4-amine;trihydrochloride is sourced from PubChem (CID 47002949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).