1-(2,5-diethoxyphenyl)-2-ethylpiperazine

C16H26N2O2 — CID 64937870

IUPAC1-(2,5-diethoxyphenyl)-2-ethylpiperazine
SMILESCCOc1ccc(OCC)c(N2CCNCC2CC)c1
InChIInChI=1S/C16H26N2O2/c1-4-13-12-17-9-10-18(13)15-11-14(19-5-2)7-8-16(15)20-6-3/h7-8,11,13,17H,4-6,9-10,12H2,1-3H3
InChIKeyGZFQSAZQQMXPAM-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.67
Rot. Bonds6

About 1-(2,5-diethoxyphenyl)-2-ethylpiperazine

1-(2,5-diethoxyphenyl)-2-ethylpiperazine (PubChem CID 64937870) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(2,5-diethoxyphenyl)-2-ethylpiperazine.

Molecular Properties

Compound Name1-(2,5-diethoxyphenyl)-2-ethylpiperazine
PubChem CID64937870
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-(2,5-diethoxyphenyl)-2-ethylpiperazine
SMILESCCOc1ccc(OCC)c(N2CCNCC2CC)c1
InChIInChI=1S/C16H26N2O2/c1-4-13-12-17-9-10-18(13)15-11-14(19-5-2)7-8-16(15)20-6-3/h7-8,11,13,17H,4-6,9-10,12H2,1-3H3
InChIKeyGZFQSAZQQMXPAM-UHFFFAOYSA-N
XLogP2.67
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-diethoxyphenyl)-2-ethylpiperazine?
The IUPAC name of 1-(2,5-diethoxyphenyl)-2-ethylpiperazine (CID 64937870) is 1-(2,5-diethoxyphenyl)-2-ethylpiperazine.
What is the SMILES notation for 1-(2,5-diethoxyphenyl)-2-ethylpiperazine?
The canonical SMILES for 1-(2,5-diethoxyphenyl)-2-ethylpiperazine is CCOc1ccc(OCC)c(N2CCNCC2CC)c1.
What is the InChIKey of 1-(2,5-diethoxyphenyl)-2-ethylpiperazine?
The InChIKey is GZFQSAZQQMXPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-13-12-17-9-10-18(13)15-11-14(19-5-2)7-8-16(15)20-6-3/h7-8,11,13,17H,4-6,9-10,12H2,1-3H3.
What are the key properties of 1-(2,5-diethoxyphenyl)-2-ethylpiperazine?
1-(2,5-diethoxyphenyl)-2-ethylpiperazine has a molecular weight of 278.40 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-diethoxyphenyl)-2-ethylpiperazine is sourced from PubChem (CID 64937870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).