1-benzylpiperidin-4-amine;piperazine

C16H28N4 — CID 68641719

IUPAC1-benzylpiperidin-4-amine;piperazine
SMILESC1CNCCN1.NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C12H18N2.C4H10N2/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11;1-2-6-4-3-5-1/h1-5,12H,6-10,13H2;5-6H,1-4H2
InChIKeyLLOXJFDJEWVNGY-UHFFFAOYSA-N
MW276.43 g/mol
LogP0.79
Rot. Bonds2

About 1-benzylpiperidin-4-amine;piperazine

1-benzylpiperidin-4-amine;piperazine (PubChem CID 68641719) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is 1-benzylpiperidin-4-amine;piperazine.

Molecular Properties

Compound Name1-benzylpiperidin-4-amine;piperazine
PubChem CID68641719
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name1-benzylpiperidin-4-amine;piperazine
SMILESC1CNCCN1.NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C12H18N2.C4H10N2/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11;1-2-6-4-3-5-1/h1-5,12H,6-10,13H2;5-6H,1-4H2
InChIKeyLLOXJFDJEWVNGY-UHFFFAOYSA-N
XLogP0.79
TPSA53.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-piperazin-1-ylphenyl)methyl]piperidin-4-amine
CID 70892281
azane;1-benzylpiperazine
CID 174866973
1-benzyl-4-(piperidin-4-ylmethoxy)piperidine
CID 67802742
1-[(3-chlorophenyl)methyl]piperidin-4-amine
CID 12641838
(1-benzylpiperidin-4-yl)methanethiol
CID 88901626
2-(1-benzylpiperidin-4-yl)ethanamine;dihydrochloride
CID 17221509
hypochlorous acid;1-(2-phenylethyl)piperidin-4-amine
CID 159010718
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
1-[(4-methylphenyl)methyl]piperidin-4-amine;hydrochloride
CID 17221614
1-[(4-phenylphenyl)methyl]pyrrolidin-3-amine
CID 62068870
1-benzyl-4-(pyrrolidin-3-ylmethyl)piperazine;dihydrochloride
CID 56831723
1-benzyl-N,N-dicyclopropylpiperidin-4-amine
CID 11097616

Frequently Asked Questions

What is the IUPAC name of 1-benzylpiperidin-4-amine;piperazine?
The IUPAC name of 1-benzylpiperidin-4-amine;piperazine (CID 68641719) is 1-benzylpiperidin-4-amine;piperazine.
What is the SMILES notation for 1-benzylpiperidin-4-amine;piperazine?
The canonical SMILES for 1-benzylpiperidin-4-amine;piperazine is C1CNCCN1.NC1CCN(Cc2ccccc2)CC1.
What is the InChIKey of 1-benzylpiperidin-4-amine;piperazine?
The InChIKey is LLOXJFDJEWVNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2.C4H10N2/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11;1-2-6-4-3-5-1/h1-5,12H,6-10,13H2;5-6H,1-4H2.
What are the key properties of 1-benzylpiperidin-4-amine;piperazine?
1-benzylpiperidin-4-amine;piperazine has a molecular weight of 276.43 g/mol, XLogP of 0.79, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylpiperidin-4-amine;piperazine is sourced from PubChem (CID 68641719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).