5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine

C14H27FN2 — CID 80697138

IUPAC5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine
SMILESCCC1(CC)CNC(C)(C2CC2)CN1CCF
InChIInChI=1S/C14H27FN2/c1-4-14(5-2)10-16-13(3,12-6-7-12)11-17(14)9-8-15/h12,16H,4-11H2,1-3H3
InChIKeyNNQOEXRSTWTZDR-UHFFFAOYSA-N
MW242.38 g/mol
LogP2.59
Rot. Bonds5

About 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine

5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine (PubChem CID 80697138) has the molecular formula C14H27FN2 and a molecular weight of 242.38 g/mol. Its IUPAC name is 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine
PubChem CID80697138
Molecular FormulaC14H27FN2
Molecular Weight242.38 g/mol
Exact Mass242.22
IUPAC Name5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine
SMILESCCC1(CC)CNC(C)(C2CC2)CN1CCF
InChIInChI=1S/C14H27FN2/c1-4-14(5-2)10-16-13(3,12-6-7-12)11-17(14)9-8-15/h12,16H,4-11H2,1-3H3
InChIKeyNNQOEXRSTWTZDR-UHFFFAOYSA-N
XLogP2.59
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.38
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclopropyl-1-(3-ethoxypropyl)-2,2-diethyl-5-methylpiperazine
CID 65177697
5-cyclopropyl-2,2-diethyl-1-(4-methoxybutyl)-5-methylpiperazine
CID 104650286
5-cyclopropyl-2,2-diethyl-1,5-dimethylpiperazine
CID 64860018
5-cyclopropyl-2,2-diethyl-5-methyl-1-(oxan-4-ylmethyl)piperazine
CID 64860212
5-cyclopropyl-1-(2-fluoroethyl)-2,5-dimethyl-2-phenylpiperazine
CID 80697580
2,5-dicyclopropyl-1-ethyl-2,5-dimethylpiperazine
CID 64859833
5-cyclopropyl-1-(3,3-dimethylbutyl)-2-ethyl-2,5-dimethylpiperazine
CID 64876359
5-cyclopropyl-2,2,5-trimethyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64876752
1-[(E)-but-2-enyl]-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 107898082
5-cyclopropyl-1-(2-methoxypropyl)-2,2,5-trimethylpiperazine
CID 113383050
2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine
CID 81114433
2,5,5-triethyl-1-(2-fluoroethyl)-2-methylpiperazine
CID 80696303

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine?
The IUPAC name of 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine (CID 80697138) is 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine.
What is the SMILES notation for 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine?
The canonical SMILES for 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine is CCC1(CC)CNC(C)(C2CC2)CN1CCF.
What is the InChIKey of 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine?
The InChIKey is NNQOEXRSTWTZDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27FN2/c1-4-14(5-2)10-16-13(3,12-6-7-12)11-17(14)9-8-15/h12,16H,4-11H2,1-3H3.
What are the key properties of 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine?
5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine has a molecular weight of 242.38 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2,2-diethyl-1-(2-fluoroethyl)-5-methylpiperazine is sourced from PubChem (CID 80697138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).