dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine

C15H25Br2CoN5 — CID 154596524

IUPACdibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine
SMILESBr[Co]Br.c1cc(CN2CCNCC2)nc(CN2CCNCC2)c1
InChIInChI=1S/C15H25N5.2BrH.Co/c1-2-14(12-19-8-4-16-5-9-19)18-15(3-1)13-20-10-6-17-7-11-20;;;/h1-3,16-17H,4-13H2;2*1H;/q;;;+2/p-2
InChIKeyAELNZCXDWLWPHO-UHFFFAOYSA-L
MW494.14 g/mol
LogP1.58
Rot. Bonds4

About dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine

dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine (PubChem CID 154596524) has the molecular formula C15H25Br2CoN5 and a molecular weight of 494.14 g/mol. Its IUPAC name is dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine.

Molecular Properties

Compound Namedibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine
PubChem CID154596524
Molecular FormulaC15H25Br2CoN5
Molecular Weight494.14 g/mol
Exact Mass491.98
IUPAC Namedibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine
SMILESBr[Co]Br.c1cc(CN2CCNCC2)nc(CN2CCNCC2)c1
InChIInChI=1S/C15H25N5.2BrH.Co/c1-2-14(12-19-8-4-16-5-9-19)18-15(3-1)13-20-10-6-17-7-11-20;;;/h1-3,16-17H,4-13H2;2*1H;/q;;;+2/p-2
InChIKeyAELNZCXDWLWPHO-UHFFFAOYSA-L
XLogP1.58
TPSA43.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.14
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine;tetrahydrochloride
CID 18770451
piperazine;1-(pyridin-2-ylmethyl)piperazine
CID 174820345
copper;6-(1,4,7,10-tetrazacyclododec-1-ylmethyl)pyridine-2-carboxylate;perchlorate
CID 139137423
5-bromo-2-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 117255711
ethane;1-(pyridin-2-ylmethyl)-1,4,7,10-tetrazacyclododecane
CID 171786933
methanamine;1-(pyridin-2-ylmethyl)piperazine
CID 142253020
[6-(azetidin-1-ylmethyl)-2-pyridinyl]methanamine
CID 105437203
2-(1,4-diazepan-1-ylmethyl)quinoline
CID 15941168
10-[[6-(methoxymethyl)-2-pyridinyl]methyl]-1,4,7,10-tetrazacyclododecane-2,6-dione
CID 11163467
(Z)-5-bromo-3-hydroxy-N-[6-(piperazin-1-ylmethyl)-2-pyridinyl]-1,3-thiazol-2-imine;ethane
CID 143349549
2-methyl-4-(piperazin-1-ylmethyl)-1,3-thiazole;dihydrochloride
CID 46735539
1-[(2,6-dichlorophenyl)methyl]piperazine
CID 770796

Frequently Asked Questions

What is the IUPAC name of dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine?
The IUPAC name of dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine (CID 154596524) is dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine.
What is the SMILES notation for dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine?
The canonical SMILES for dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine is Br[Co]Br.c1cc(CN2CCNCC2)nc(CN2CCNCC2)c1.
What is the InChIKey of dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine?
The InChIKey is AELNZCXDWLWPHO-UHFFFAOYSA-L. The full InChI is InChI=1S/C15H25N5.2BrH.Co/c1-2-14(12-19-8-4-16-5-9-19)18-15(3-1)13-20-10-6-17-7-11-20;;;/h1-3,16-17H,4-13H2;2*1H;/q;;;+2/p-2.
What are the key properties of dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine?
dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine has a molecular weight of 494.14 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dibromocobalt;1-[[6-(piperazin-1-ylmethyl)-2-pyridinyl]methyl]piperazine is sourced from PubChem (CID 154596524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).