1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride

C10H22ClN3 — CID 131203794

IUPAC1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride
SMILESCCCC1CN(C2CNC2)CCN1.Cl
InChIInChI=1S/C10H21N3.ClH/c1-2-3-9-8-13(5-4-12-9)10-6-11-7-10;/h9-12H,2-8H2,1H3;1H
InChIKeyFNKXAHLCMJVRQU-UHFFFAOYSA-N
MW219.76 g/mol
LogP0.45
Rot. Bonds3

About 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride

1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride (PubChem CID 131203794) has the molecular formula C10H22ClN3 and a molecular weight of 219.76 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride.

Molecular Properties

Compound Name1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride
PubChem CID131203794
Molecular FormulaC10H22ClN3
Molecular Weight219.76 g/mol
Exact Mass219.15
IUPAC Name1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride
SMILESCCCC1CN(C2CNC2)CCN1.Cl
InChIInChI=1S/C10H21N3.ClH/c1-2-3-9-8-13(5-4-12-9)10-6-11-7-10;/h9-12H,2-8H2,1H3;1H
InChIKeyFNKXAHLCMJVRQU-UHFFFAOYSA-N
XLogP0.45
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.76
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclooctyl-3-propylpiperazine
CID 64924184
3-propyl-1-(4-propylcyclohexyl)piperazine
CID 64926746
[(3S)-2,3,4,6,7,8,9,9a-octahydro-1H-pyrazino[1,2-a]pyrazin-3-yl]methanol
CID 59215758
3-ethyl-1-(1-methylazetidin-3-yl)piperazine
CID 131042809
1-(3-ethylcyclohexyl)-3-propyl-1,4-diazepane
CID 64949456
[4-[(3S)-2,3,4,6,7,8,9,9a-octahydro-1H-pyrazino[1,2-a]pyrazin-3-yl]-2-methylbutan-2-yl]-hydroxy-dimethylsilane
CID 70318951
3-(3-propyl-1,4-diazepan-1-yl)thiolane 1,1-dioxide
CID 64944268
1-heptan-2-yl-3-propylpiperazine
CID 64924539
1-octan-4-yl-3-propylpiperazine
CID 114138506
1-(2,2-dimethylpropyl)-3-propylpiperazine
CID 64925908
1-(3-methylpentan-3-yl)-3-propylpiperazine
CID 106329754
1-(3-methylsulfanylcyclohexyl)-3-propyl-1,4-diazepane
CID 114122783

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride?
The IUPAC name of 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride (CID 131203794) is 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride.
What is the SMILES notation for 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride?
The canonical SMILES for 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride is CCCC1CN(C2CNC2)CCN1.Cl.
What is the InChIKey of 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride?
The InChIKey is FNKXAHLCMJVRQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3.ClH/c1-2-3-9-8-13(5-4-12-9)10-6-11-7-10;/h9-12H,2-8H2,1H3;1H.
What are the key properties of 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride?
1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride has a molecular weight of 219.76 g/mol, XLogP of 0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-3-propylpiperazine;hydrochloride is sourced from PubChem (CID 131203794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).