2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine

C14H27FN2 — CID 81114433

IUPAC2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine
SMILESCCC1(C)CN(CCCF)C(C)(C2CC2)CN1
InChIInChI=1S/C14H27FN2/c1-4-13(2)11-17(9-5-8-15)14(3,10-16-13)12-6-7-12/h12,16H,4-11H2,1-3H3
InChIKeyPKGAYZQMTZUPLM-UHFFFAOYSA-N
MW242.38 g/mol
LogP2.59
Rot. Bonds5

About 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine

2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine (PubChem CID 81114433) has the molecular formula C14H27FN2 and a molecular weight of 242.38 g/mol. Its IUPAC name is 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine.

Molecular Properties

Compound Name2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine
PubChem CID81114433
Molecular FormulaC14H27FN2
Molecular Weight242.38 g/mol
Exact Mass242.22
IUPAC Name2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine
SMILESCCC1(C)CN(CCCF)C(C)(C2CC2)CN1
InChIInChI=1S/C14H27FN2/c1-4-13(2)11-17(9-5-8-15)14(3,10-16-13)12-6-7-12/h12,16H,4-11H2,1-3H3
InChIKeyPKGAYZQMTZUPLM-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

Analyze 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-ethyl-6-(3-fluoropropyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 81114319
2-cyclopropyl-2,5,5-trimethyl-1-(4,4,4-trifluorobutyl)piperazine
CID 115518869
2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-5-methylpiperazine
CID 81113712
1-butyl-2,5-diethyl-2,5-dimethylpiperazine
CID 64849689
2-cyclopropyl-5-ethyl-2,5-dimethyl-1-pentan-2-ylpiperazine
CID 107888613
2-cyclopropyl-2,5,5-trimethyl-1-(2-propylsulfonylethyl)piperazine
CID 106732968
2-cyclopropyl-5,5-diethyl-2-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 115943677
2,5-dicyclopropyl-1-ethyl-2,5-dimethylpiperazine
CID 64859833
2-cyclopropyl-1-(2-methoxyethyl)-2,5,5-trimethylpiperazine
CID 64841123
2-tert-butyl-5-ethyl-1-(3-fluoropropyl)-5-methylpiperazine
CID 81113839
5-ethyl-1-(3-fluoropropyl)-5-methyl-2-propan-2-ylpiperazine
CID 81113589
5-ethyl-2,2,5-trimethyl-1-(2,2,2-trifluoroethyl)piperazine
CID 64848330

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine?
The IUPAC name of 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine (CID 81114433) is 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine.
What is the SMILES notation for 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine?
The canonical SMILES for 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine is CCC1(C)CN(CCCF)C(C)(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine?
The InChIKey is PKGAYZQMTZUPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27FN2/c1-4-13(2)11-17(9-5-8-15)14(3,10-16-13)12-6-7-12/h12,16H,4-11H2,1-3H3.
What are the key properties of 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine?
2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine 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 2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine is sourced from PubChem (CID 81114433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).