hydron;1-propylpiperazine;dibromide

C7H18Br2N2 — CID 91980567

IUPAChydron;1-propylpiperazine;dibromide
SMILESCCCN1CCNCC1.[Br-].[Br-].[H+].[H+]
InChIInChI=1S/C7H16N2.2BrH/c1-2-5-9-6-3-8-4-7-9;;/h8H,2-7H2,1H3;2*1H
InChIKeyYTPQLWVHCBATKO-UHFFFAOYSA-N
MW290.04 g/mol
LogP-5.47
Rot. Bonds2

About hydron;1-propylpiperazine;dibromide

hydron;1-propylpiperazine;dibromide (PubChem CID 91980567) has the molecular formula C7H18Br2N2 and a molecular weight of 290.04 g/mol. Its IUPAC name is hydron;1-propylpiperazine;dibromide.

Molecular Properties

Compound Namehydron;1-propylpiperazine;dibromide
PubChem CID91980567
Molecular FormulaC7H18Br2N2
Molecular Weight290.04 g/mol
Exact Mass287.98
IUPAC Namehydron;1-propylpiperazine;dibromide
SMILESCCCN1CCNCC1.[Br-].[Br-].[H+].[H+]
InChIInChI=1S/C7H16N2.2BrH/c1-2-5-9-6-3-8-4-7-9;;/h8H,2-7H2,1H3;2*1H
InChIKeyYTPQLWVHCBATKO-UHFFFAOYSA-N
XLogP-5.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.04
LogP ≤ 5-5.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hydron;1-propylpiperazine;dibromide?
The IUPAC name of hydron;1-propylpiperazine;dibromide (CID 91980567) is hydron;1-propylpiperazine;dibromide.
What is the SMILES notation for hydron;1-propylpiperazine;dibromide?
The canonical SMILES for hydron;1-propylpiperazine;dibromide is CCCN1CCNCC1.[Br-].[Br-].[H+].[H+].
What is the InChIKey of hydron;1-propylpiperazine;dibromide?
The InChIKey is YTPQLWVHCBATKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.2BrH/c1-2-5-9-6-3-8-4-7-9;;/h8H,2-7H2,1H3;2*1H.
What are the key properties of hydron;1-propylpiperazine;dibromide?
hydron;1-propylpiperazine;dibromide has a molecular weight of 290.04 g/mol, XLogP of -5.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;1-propylpiperazine;dibromide is sourced from PubChem (CID 91980567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).