2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine

C12H23FN2 — CID 80697422

IUPAC2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine
SMILESCCC1CN(CCF)C(C)(C2CC2)CN1
InChIInChI=1S/C12H23FN2/c1-3-11-8-15(7-6-13)12(2,9-14-11)10-4-5-10/h10-11,14H,3-9H2,1-2H3
InChIKeyQAHIHYAMGZZRIY-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.81
Rot. Bonds4

About 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine

2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine (PubChem CID 80697422) has the molecular formula C12H23FN2 and a molecular weight of 214.33 g/mol. Its IUPAC name is 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine.

Molecular Properties

Compound Name2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine
PubChem CID80697422
Molecular FormulaC12H23FN2
Molecular Weight214.33 g/mol
Exact Mass214.18
IUPAC Name2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine
SMILESCCC1CN(CCF)C(C)(C2CC2)CN1
InChIInChI=1S/C12H23FN2/c1-3-11-8-15(7-6-13)12(2,9-14-11)10-4-5-10/h10-11,14H,3-9H2,1-2H3
InChIKeyQAHIHYAMGZZRIY-UHFFFAOYSA-N
XLogP1.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine?
The IUPAC name of 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine (CID 80697422) is 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine.
What is the SMILES notation for 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine?
The canonical SMILES for 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine is CCC1CN(CCF)C(C)(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine?
The InChIKey is QAHIHYAMGZZRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23FN2/c1-3-11-8-15(7-6-13)12(2,9-14-11)10-4-5-10/h10-11,14H,3-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine?
2-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine has a molecular weight of 214.33 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-cyclopropyl-5-ethyl-1-(2-fluoroethyl)-2-methylpiperazine is sourced from PubChem (CID 80697422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).