5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine

C18H28N2O — CID 106261608

IUPAC5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine
SMILESCCC1CNC(C2CC2)CN1CCc1ccccc1OC
InChIInChI=1S/C18H28N2O/c1-3-16-12-19-17(14-8-9-14)13-20(16)11-10-15-6-4-5-7-18(15)21-2/h4-7,14,16-17,19H,3,8-13H2,1-2H3
InChIKeyNGCBDNCPGCHXEV-UHFFFAOYSA-N
MW288.43 g/mol
LogP2.70
Rot. Bonds6

About 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine

5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine (PubChem CID 106261608) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine
PubChem CID106261608
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine
SMILESCCC1CNC(C2CC2)CN1CCc1ccccc1OC
InChIInChI=1S/C18H28N2O/c1-3-16-12-19-17(14-8-9-14)13-20(16)11-10-15-6-4-5-7-18(15)21-2/h4-7,14,16-17,19H,3,8-13H2,1-2H3
InChIKeyNGCBDNCPGCHXEV-UHFFFAOYSA-N
XLogP2.70
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-1-[(2-methoxyphenyl)methyl]-2-propan-2-ylpiperazine
CID 64861840
5-cyclopropyl-1-[(2,3-dichlorophenyl)methyl]-2-ethylpiperazine
CID 107310519
5-cyclopropyl-1,2-diethylpiperazine
CID 64862405
1-(2-cyclopentyloxyethyl)-5-cyclopropyl-2-ethylpiperazine
CID 64940447
5-cyclopropyl-2-ethyl-1-[(4-methylphenyl)methyl]piperazine
CID 64861828
1-[2-(2-methoxyphenyl)ethyl]-2-methylpiperazine
CID 82083206
2-benzyl-1-butyl-5-cyclopropylpiperazine
CID 64860330
5-cyclopropyl-2-ethyl-1-[(2-methoxyphenyl)methyl]-2-methylpiperazine
CID 64862069
1-[2-(2-methoxyphenyl)ethyl]-2-methyl-5-(2-methylpropyl)piperazine
CID 106261615
1-[2-(2-methoxyphenyl)ethyl]-2-methylpyrrolidine
CID 75030496
5-cyclopropyl-2-ethyl-1-(2-propan-2-ylphenyl)piperazine
CID 64931562
5,5-diethyl-1-[2-(2-methoxyphenyl)ethyl]-2-methylpiperazine
CID 106261604

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine (CID 106261608) is 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine is CCC1CNC(C2CC2)CN1CCc1ccccc1OC.
What is the InChIKey of 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine?
The InChIKey is NGCBDNCPGCHXEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-3-16-12-19-17(14-8-9-14)13-20(16)11-10-15-6-4-5-7-18(15)21-2/h4-7,14,16-17,19H,3,8-13H2,1-2H3.
What are the key properties of 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine?
5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine has a molecular weight of 288.43 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-ethyl-1-[2-(2-methoxyphenyl)ethyl]piperazine is sourced from PubChem (CID 106261608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).