1-(ethoxymethyl)-4-ethylpiperazine

C9H20N2O — CID 20796065

IUPAC1-(ethoxymethyl)-4-ethylpiperazine
SMILESCCOCN1CCN(CC)CC1
InChIInChI=1S/C9H20N2O/c1-3-10-5-7-11(8-6-10)9-12-4-2/h3-9H2,1-2H3
InChIKeyDNOVSFXWJJOIOA-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.62
Rot. Bonds4

About 1-(ethoxymethyl)-4-ethylpiperazine

1-(ethoxymethyl)-4-ethylpiperazine (PubChem CID 20796065) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 1-(ethoxymethyl)-4-ethylpiperazine.

Molecular Properties

Compound Name1-(ethoxymethyl)-4-ethylpiperazine
PubChem CID20796065
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name1-(ethoxymethyl)-4-ethylpiperazine
SMILESCCOCN1CCN(CC)CC1
InChIInChI=1S/C9H20N2O/c1-3-10-5-7-11(8-6-10)9-12-4-2/h3-9H2,1-2H3
InChIKeyDNOVSFXWJJOIOA-UHFFFAOYSA-N
XLogP0.62
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-4-ethylpiperazine?
The IUPAC name of 1-(ethoxymethyl)-4-ethylpiperazine (CID 20796065) is 1-(ethoxymethyl)-4-ethylpiperazine.
What is the SMILES notation for 1-(ethoxymethyl)-4-ethylpiperazine?
The canonical SMILES for 1-(ethoxymethyl)-4-ethylpiperazine is CCOCN1CCN(CC)CC1.
What is the InChIKey of 1-(ethoxymethyl)-4-ethylpiperazine?
The InChIKey is DNOVSFXWJJOIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-3-10-5-7-11(8-6-10)9-12-4-2/h3-9H2,1-2H3.
What are the key properties of 1-(ethoxymethyl)-4-ethylpiperazine?
1-(ethoxymethyl)-4-ethylpiperazine has a molecular weight of 172.27 g/mol, XLogP of 0.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-4-ethylpiperazine is sourced from PubChem (CID 20796065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).