1-(2,3-dimethoxypropyl)piperazine

C9H20N2O2 — CID 10583784

IUPAC1-(2,3-dimethoxypropyl)piperazine
SMILESCOCC(CN1CCNCC1)OC
InChIInChI=1S/C9H20N2O2/c1-12-8-9(13-2)7-11-5-3-10-4-6-11/h9-10H,3-8H2,1-2H3
InChIKeyVXSDCSNXIDVDPO-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.45
Rot. Bonds5

About 1-(2,3-dimethoxypropyl)piperazine

1-(2,3-dimethoxypropyl)piperazine (PubChem CID 10583784) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-(2,3-dimethoxypropyl)piperazine.

Molecular Properties

Compound Name1-(2,3-dimethoxypropyl)piperazine
PubChem CID10583784
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name1-(2,3-dimethoxypropyl)piperazine
SMILESCOCC(CN1CCNCC1)OC
InChIInChI=1S/C9H20N2O2/c1-12-8-9(13-2)7-11-5-3-10-4-6-11/h9-10H,3-8H2,1-2H3
InChIKeyVXSDCSNXIDVDPO-UHFFFAOYSA-N
XLogP-0.45
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethoxypropyl)piperazine?
The IUPAC name of 1-(2,3-dimethoxypropyl)piperazine (CID 10583784) is 1-(2,3-dimethoxypropyl)piperazine.
What is the SMILES notation for 1-(2,3-dimethoxypropyl)piperazine?
The canonical SMILES for 1-(2,3-dimethoxypropyl)piperazine is COCC(CN1CCNCC1)OC.
What is the InChIKey of 1-(2,3-dimethoxypropyl)piperazine?
The InChIKey is VXSDCSNXIDVDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-12-8-9(13-2)7-11-5-3-10-4-6-11/h9-10H,3-8H2,1-2H3.
What are the key properties of 1-(2,3-dimethoxypropyl)piperazine?
1-(2,3-dimethoxypropyl)piperazine has a molecular weight of 188.27 g/mol, XLogP of -0.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethoxypropyl)piperazine is sourced from PubChem (CID 10583784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).