1-propylpiperazine;dihydrobromide

C7H18Br2N2 — CID 3085288

IUPAC1-propylpiperazine;dihydrobromide
SMILESBr.Br.CCCN1CCNCC1
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
LogP1.46
Rot. Bonds2

About 1-propylpiperazine;dihydrobromide

1-propylpiperazine;dihydrobromide (PubChem CID 3085288) has the molecular formula C7H18Br2N2 and a molecular weight of 290.04 g/mol. Its IUPAC name is 1-propylpiperazine;dihydrobromide.

Molecular Properties

Compound Name1-propylpiperazine;dihydrobromide
PubChem CID3085288
Molecular FormulaC7H18Br2N2
Molecular Weight290.04 g/mol
Exact Mass287.98
IUPAC Name1-propylpiperazine;dihydrobromide
SMILESBr.Br.CCCN1CCNCC1
InChIInChI=1S/C7H16N2.2BrH/c1-2-5-9-6-3-8-4-7-9;;/h8H,2-7H2,1H3;2*1H
InChIKeyYTPQLWVHCBATKO-UHFFFAOYSA-N
XLogP1.46
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 ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Isopropylpiperazine
CID 78013
1-(2-(Dimethylamino)ethyl)piperazine
CID 2736229
1-(3-Aminopropyl)-4-methylpiperazine
CID 78328
1-(2-Methylpropyl)piperazine
CID 2052052
Dimethylpiperazine
CID 198037
1-Butylpiperazine
CID 424322
1,2,2-Trimethylpiperazine
CID 21973776
1-(Butan-2-yl)piperazine
CID 2735696
3-(4-Ethylpiperazin-1-yl)propan-1-amine
CID 3149267
4-(4-Methylpiperazin-1-yl)butan-1-amine
CID 6484192
N,N-Diethyl-2-(piperazin-1-yl)ethan-1-amine
CID 2736105
1-[3-(Dimethylamino)propyl]piperazine
CID 2736234

Frequently Asked Questions

What is the IUPAC name of 1-propylpiperazine;dihydrobromide?
The IUPAC name of 1-propylpiperazine;dihydrobromide (CID 3085288) is 1-propylpiperazine;dihydrobromide.
What is the SMILES notation for 1-propylpiperazine;dihydrobromide?
The canonical SMILES for 1-propylpiperazine;dihydrobromide is Br.Br.CCCN1CCNCC1.
What is the InChIKey of 1-propylpiperazine;dihydrobromide?
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 1-propylpiperazine;dihydrobromide?
1-propylpiperazine;dihydrobromide has a molecular weight of 290.04 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylpiperazine;dihydrobromide is sourced from PubChem (CID 3085288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).