1-(2-methylpropyl)piperazine;dihydrochloride

C8H20Cl2N2 — CID 2759388

IUPAC1-(2-methylpropyl)piperazine;dihydrochloride
SMILESCC(C)CN1CCNCC1.Cl.Cl
InChIInChI=1S/C8H18N2.2ClH/c1-8(2)7-10-5-3-9-4-6-10;;/h8-9H,3-7H2,1-2H3;2*1H
InChIKeyKPVDVCZLTWMQNX-UHFFFAOYSA-N
MW215.17 g/mol
LogP1.39
Rot. Bonds2

About 1-(2-methylpropyl)piperazine;dihydrochloride

1-(2-methylpropyl)piperazine;dihydrochloride (PubChem CID 2759388) has the molecular formula C8H20Cl2N2 and a molecular weight of 215.17 g/mol. Its IUPAC name is 1-(2-methylpropyl)piperazine;dihydrochloride.

Molecular Properties

Compound Name1-(2-methylpropyl)piperazine;dihydrochloride
PubChem CID2759388
Molecular FormulaC8H20Cl2N2
Molecular Weight215.17 g/mol
Exact Mass214.10
IUPAC Name1-(2-methylpropyl)piperazine;dihydrochloride
SMILESCC(C)CN1CCNCC1.Cl.Cl
InChIInChI=1S/C8H18N2.2ClH/c1-8(2)7-10-5-3-9-4-6-10;;/h8-9H,3-7H2,1-2H3;2*1H
InChIKeyKPVDVCZLTWMQNX-UHFFFAOYSA-N
XLogP1.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.17
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-Methylpropyl)piperazine
CID 2052052
1-Butylpiperazine
CID 424322
1-Piperazinepropanamine, 4-methyl-, trihydrochloride
CID 3050147
1-[3-(Dimethylamino)propyl]piperazine
CID 2736234
N-(2-(Piperazin-1-yl)ethyl)-N-propylpropan-1-amine
CID 2736329
Methyl(3-(4-methylpiperazin-1-yl)propyl)amine
CID 7219854
1-(3-Methylbutyl)piperazine
CID 10057758
1-Ethyl-3,3-dimethylpiperazine
CID 56924066
1-Tert-butyl-3,3-dimethylpiperazine
CID 57665743
1-sec-Butyl-piperazine hydrochloride
CID 16189617
Piperazine, 1-propyl-, hydrochloride (1:2)
CID 415812
1-(3-Diethylaminopropyl)Piperazine
CID 2736106

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)piperazine;dihydrochloride?
The IUPAC name of 1-(2-methylpropyl)piperazine;dihydrochloride (CID 2759388) is 1-(2-methylpropyl)piperazine;dihydrochloride.
What is the SMILES notation for 1-(2-methylpropyl)piperazine;dihydrochloride?
The canonical SMILES for 1-(2-methylpropyl)piperazine;dihydrochloride is CC(C)CN1CCNCC1.Cl.Cl.
What is the InChIKey of 1-(2-methylpropyl)piperazine;dihydrochloride?
The InChIKey is KPVDVCZLTWMQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2.2ClH/c1-8(2)7-10-5-3-9-4-6-10;;/h8-9H,3-7H2,1-2H3;2*1H.
What are the key properties of 1-(2-methylpropyl)piperazine;dihydrochloride?
1-(2-methylpropyl)piperazine;dihydrochloride has a molecular weight of 215.17 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)piperazine;dihydrochloride is sourced from PubChem (CID 2759388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).