5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine

C17H25FN2 — CID 64945697

IUPAC5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine
SMILESCC1CNC(C)(C2CC2)CN1C(C)c1ccccc1F
InChIInChI=1S/C17H25FN2/c1-12-10-19-17(3,14-8-9-14)11-20(12)13(2)15-6-4-5-7-16(15)18/h4-7,12-14,19H,8-11H2,1-3H3
InChIKeyLKKSVJKBEBWNKZ-UHFFFAOYSA-N
MW276.40 g/mol
LogP3.35
Rot. Bonds3

About 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine

5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine (PubChem CID 64945697) has the molecular formula C17H25FN2 and a molecular weight of 276.40 g/mol. Its IUPAC name is 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine
PubChem CID64945697
Molecular FormulaC17H25FN2
Molecular Weight276.40 g/mol
Exact Mass276.20
IUPAC Name5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine
SMILESCC1CNC(C)(C2CC2)CN1C(C)c1ccccc1F
InChIInChI=1S/C17H25FN2/c1-12-10-19-17(3,14-8-9-14)11-20(12)13(2)15-6-4-5-7-16(15)18/h4-7,12-14,19H,8-11H2,1-3H3
InChIKeyLKKSVJKBEBWNKZ-UHFFFAOYSA-N
XLogP3.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclopropyl-2,5-dimethyl-1-(1-thiophen-2-ylethyl)piperazine
CID 64933400
5-cyclopropyl-1-[1-(2,5-dimethylfuran-3-yl)ethyl]-2,5-dimethylpiperazine
CID 64946933
5-cyclopropyl-2,5-dimethyl-1-propan-2-ylpiperazine
CID 64875943
5-cyclopropyl-1-[(2-fluorophenyl)methyl]-2,5-dimethylpiperazine
CID 64875570
5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine
CID 64932001
2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
CID 106389937
5-cyclopropyl-1-(3,3-dimethylbutan-2-yl)-2,5-dimethylpiperazine
CID 104830157
5-cyclopropyl-1-[(2-fluorophenyl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64877110
5-cyclopropyl-2,5-dimethyl-1-phenylpiperazine
CID 64932614
5-ethyl-1-[1-(2-fluorophenyl)ethyl]-2-methylpiperazine
CID 64945888
3-cyclopropyl-1-[(2-fluorophenyl)methyl]-3,7-dimethyl-1,4-diazepane
CID 64870220
3-cyclopropyl-3-methyl-1-[1-(2-methylphenyl)ethyl]piperazine
CID 64926146

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine?
The IUPAC name of 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine (CID 64945697) is 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine is CC1CNC(C)(C2CC2)CN1C(C)c1ccccc1F.
What is the InChIKey of 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine?
The InChIKey is LKKSVJKBEBWNKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2/c1-12-10-19-17(3,14-8-9-14)11-20(12)13(2)15-6-4-5-7-16(15)18/h4-7,12-14,19H,8-11H2,1-3H3.
What are the key properties of 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine?
5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine has a molecular weight of 276.40 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine is sourced from PubChem (CID 64945697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).