1-(3,5-dimethoxyphenyl)-4-ethylpiperazine

C14H22N2O2 — CID 143598581

IUPAC1-(3,5-dimethoxyphenyl)-4-ethylpiperazine
SMILESCCN1CCN(c2cc(OC)cc(OC)c2)CC1
InChIInChI=1S/C14H22N2O2/c1-4-15-5-7-16(8-6-15)12-9-13(17-2)11-14(10-12)18-3/h9-11H,4-8H2,1-3H3
InChIKeyHFVJQLAJIKCGMO-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.85
Rot. Bonds4

About 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine

1-(3,5-dimethoxyphenyl)-4-ethylpiperazine (PubChem CID 143598581) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine.

Molecular Properties

Compound Name1-(3,5-dimethoxyphenyl)-4-ethylpiperazine
PubChem CID143598581
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name1-(3,5-dimethoxyphenyl)-4-ethylpiperazine
SMILESCCN1CCN(c2cc(OC)cc(OC)c2)CC1
InChIInChI=1S/C14H22N2O2/c1-4-15-5-7-16(8-6-15)12-9-13(17-2)11-14(10-12)18-3/h9-11H,4-8H2,1-3H3
InChIKeyHFVJQLAJIKCGMO-UHFFFAOYSA-N
XLogP1.85
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine?
The IUPAC name of 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine (CID 143598581) is 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine.
What is the SMILES notation for 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine?
The canonical SMILES for 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine is CCN1CCN(c2cc(OC)cc(OC)c2)CC1.
What is the InChIKey of 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine?
The InChIKey is HFVJQLAJIKCGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-15-5-7-16(8-6-15)12-9-13(17-2)11-14(10-12)18-3/h9-11H,4-8H2,1-3H3.
What are the key properties of 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine?
1-(3,5-dimethoxyphenyl)-4-ethylpiperazine has a molecular weight of 250.34 g/mol, XLogP of 1.85, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxyphenyl)-4-ethylpiperazine is sourced from PubChem (CID 143598581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).