2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine

C13H23FN2 — CID 80698037

IUPAC2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine
SMILESCC1(C2CC2)CNC(C2CC2)CN1CCF
InChIInChI=1S/C13H23FN2/c1-13(11-4-5-11)9-15-12(10-2-3-10)8-16(13)7-6-14/h10-12,15H,2-9H2,1H3
InChIKeyWZUFNEULMQKUCD-UHFFFAOYSA-N
MW226.34 g/mol
LogP1.81
Rot. Bonds4

About 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine

2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine (PubChem CID 80698037) has the molecular formula C13H23FN2 and a molecular weight of 226.34 g/mol. Its IUPAC name is 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine.

Molecular Properties

Compound Name2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine
PubChem CID80698037
Molecular FormulaC13H23FN2
Molecular Weight226.34 g/mol
Exact Mass226.18
IUPAC Name2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine
SMILESCC1(C2CC2)CNC(C2CC2)CN1CCF
InChIInChI=1S/C13H23FN2/c1-13(11-4-5-11)9-15-12(10-2-3-10)8-16(13)7-6-14/h10-12,15H,2-9H2,1H3
InChIKeyWZUFNEULMQKUCD-UHFFFAOYSA-N
XLogP1.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dicyclopropyl-1-(3-methoxypropyl)-2-methylpiperazine
CID 64859583
2,5-dicyclopropyl-2-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64862471
2,5-dicyclopropyl-2-methyl-1-(2-pyrazol-1-ylethyl)piperazine
CID 64862475
2,5-dicyclopropyl-2-methyl-1-[(1-methylpyrazol-3-yl)methyl]piperazine
CID 82872478
1-[(5-chlorothiophen-2-yl)methyl]-2,5-dicyclopropyl-2-methylpiperazine
CID 64859591
1-[(3-bromothiophen-2-yl)methyl]-2,5-dicyclopropyl-2-methylpiperazine
CID 64860355
2-cyclopropyl-2,5-dimethyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64843995
1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
CID 64844568
5-cyclopropyl-2-ethyl-2-methyl-1-propylpiperazine
CID 64862262
5-cyclopropyl-1,2,2-trimethylpiperazine
CID 64860529
2-cyclopropyl-2,5-dimethyl-1-(2-propoxyethyl)piperazine
CID 106458523
1-butyl-2-cyclopropyl-2-methyl-5-propylpiperazine
CID 64839603

Frequently Asked Questions

What is the IUPAC name of 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine?
The IUPAC name of 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine (CID 80698037) is 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine.
What is the SMILES notation for 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine?
The canonical SMILES for 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine is CC1(C2CC2)CNC(C2CC2)CN1CCF.
What is the InChIKey of 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine?
The InChIKey is WZUFNEULMQKUCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23FN2/c1-13(11-4-5-11)9-15-12(10-2-3-10)8-16(13)7-6-14/h10-12,15H,2-9H2,1H3.
What are the key properties of 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine?
2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine has a molecular weight of 226.34 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dicyclopropyl-1-(2-fluoroethyl)-2-methylpiperazine is sourced from PubChem (CID 80698037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).