1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine

C17H28N2O2 — CID 2215919

IUPAC1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine
SMILESCCCOc1cccc(OCCN2CCN(CC)CC2)c1
InChIInChI=1S/C17H28N2O2/c1-3-13-20-16-6-5-7-17(15-16)21-14-12-19-10-8-18(4-2)9-11-19/h5-7,15H,3-4,8-14H2,1-2H3
InChIKeyWZCUZNHHCQRGTM-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.49
Rot. Bonds8

About 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine

1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine (PubChem CID 2215919) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine.

Molecular Properties

Compound Name1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine
PubChem CID2215919
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine
SMILESCCCOc1cccc(OCCN2CCN(CC)CC2)c1
InChIInChI=1S/C17H28N2O2/c1-3-13-20-16-6-5-7-17(15-16)21-14-12-19-10-8-18(4-2)9-11-19/h5-7,15H,3-4,8-14H2,1-2H3
InChIKeyWZCUZNHHCQRGTM-UHFFFAOYSA-N
XLogP2.49
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]-N-methylmethanamine
CID 62419745
3-[2-(4-propylpiperazin-1-yl)ethoxy]aniline
CID 43174249
4-[2-(3-butoxyphenoxy)ethyl]morpholine
CID 2993436
(2R,6S)-2,6-dimethyl-4-[2-(3-propoxyphenoxy)ethyl]morpholine
CID 7394222
3-[2-(4-propylpiperazin-1-yl)ethoxy]benzonitrile
CID 43288798
1-ethyl-4-(3-phenoxypropyl)piperazine
CID 51072960
1-methyl-4-[(3-propoxyphenyl)methyl]piperazine
CID 70470634
1-ethyl-4-[2-(4-iodophenoxy)ethyl]piperazine
CID 1300408
1-[2-(4-bromophenoxy)ethyl]-4-ethylpiperazine
CID 60644690
1-ethyl-4-[2-(4-fluorophenoxy)ethyl]piperazine
CID 1301156
1-[2-(4-chloro-3-ethylphenoxy)ethyl]-4-ethylpiperazine
CID 973456
1-[2-(3-ethoxyphenoxy)ethyl]piperazine;oxalic acid
CID 2944385

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine?
The IUPAC name of 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine (CID 2215919) is 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine.
What is the SMILES notation for 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine?
The canonical SMILES for 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine is CCCOc1cccc(OCCN2CCN(CC)CC2)c1.
What is the InChIKey of 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine?
The InChIKey is WZCUZNHHCQRGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-3-13-20-16-6-5-7-17(15-16)21-14-12-19-10-8-18(4-2)9-11-19/h5-7,15H,3-4,8-14H2,1-2H3.
What are the key properties of 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine?
1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine has a molecular weight of 292.42 g/mol, XLogP of 2.49, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[2-(3-propoxyphenoxy)ethyl]piperazine is sourced from PubChem (CID 2215919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).