1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine

C10H21N3O — CID 66204108

IUPAC1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine
SMILESCOCCN1CCN(C2CNC2)CC1
InChIInChI=1S/C10H21N3O/c1-14-7-6-12-2-4-13(5-3-12)10-8-11-9-10/h10-11H,2-9H2,1H3
InChIKeyHSIRANKHYDLGFV-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.78
Rot. Bonds4

About 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine

1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine (PubChem CID 66204108) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine
PubChem CID66204108
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine
SMILESCOCCN1CCN(C2CNC2)CC1
InChIInChI=1S/C10H21N3O/c1-14-7-6-12-2-4-13(5-3-12)10-8-11-9-10/h10-11H,2-9H2,1H3
InChIKeyHSIRANKHYDLGFV-UHFFFAOYSA-N
XLogP-0.78
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine?
The IUPAC name of 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine (CID 66204108) is 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine.
What is the SMILES notation for 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine?
The canonical SMILES for 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine is COCCN1CCN(C2CNC2)CC1.
What is the InChIKey of 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine?
The InChIKey is HSIRANKHYDLGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-14-7-6-12-2-4-13(5-3-12)10-8-11-9-10/h10-11H,2-9H2,1H3.
What are the key properties of 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine?
1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine has a molecular weight of 199.30 g/mol, XLogP of -0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-4-(2-methoxyethyl)piperazine is sourced from PubChem (CID 66204108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).