5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine

C17H26N2 — CID 64948199

IUPAC5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine
SMILESCc1ccccc1C(C)N1CC(C2CC2)NCC1C
InChIInChI=1S/C17H26N2/c1-12-6-4-5-7-16(12)14(3)19-11-17(15-8-9-15)18-10-13(19)2/h4-7,13-15,17-18H,8-11H2,1-3H3
InChIKeyWSNFFGLKAHTAOJ-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.13
Rot. Bonds3

About 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine

5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine (PubChem CID 64948199) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine
PubChem CID64948199
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine
SMILESCc1ccccc1C(C)N1CC(C2CC2)NCC1C
InChIInChI=1S/C17H26N2/c1-12-6-4-5-7-16(12)14(3)19-11-17(15-8-9-15)18-10-13(19)2/h4-7,13-15,17-18H,8-11H2,1-3H3
InChIKeyWSNFFGLKAHTAOJ-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclopropyl-1-[1-(2-methylphenyl)ethyl]-2-propan-2-ylpiperazine
CID 64947427
5-butan-2-yl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine
CID 64939080
5-cyclopropyl-2-methyl-1-(1-pyridin-4-ylethyl)piperazine
CID 64933586
1-[1-(3-chlorophenyl)ethyl]-5-cyclopropyl-2-methylpiperazine
CID 64946271
(3aR,6aS)-5-[1-(2-methylphenyl)ethyl]-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 114042199
5-cyclohexyl-2-methyl-1-(1-thiophen-3-ylethyl)piperazine
CID 64939615
5-cyclopropyl-1-(3-methylbutan-2-yl)-2-phenylpiperazine
CID 64934608
5-cyclopropyl-2-ethyl-1-(2-propan-2-ylphenyl)piperazine
CID 64931562
5-cyclopropyl-1-(3,3-dimethylbutan-2-yl)-2-phenylpiperazine
CID 104830214
5-ethyl-1-[1-(2-fluorophenyl)ethyl]-2-methylpiperazine
CID 64945888
5-cyclopropyl-1-(2,4-dimethylphenyl)-2-methylpiperazine
CID 64930667
5-cyclopropyl-1-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-methylpiperazine
CID 64947751

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine?
The IUPAC name of 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine (CID 64948199) is 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine.
What is the SMILES notation for 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine?
The canonical SMILES for 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine is Cc1ccccc1C(C)N1CC(C2CC2)NCC1C.
What is the InChIKey of 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine?
The InChIKey is WSNFFGLKAHTAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-12-6-4-5-7-16(12)14(3)19-11-17(15-8-9-15)18-10-13(19)2/h4-7,13-15,17-18H,8-11H2,1-3H3.
What are the key properties of 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine?
5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine has a molecular weight of 258.41 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-methyl-1-[1-(2-methylphenyl)ethyl]piperazine is sourced from PubChem (CID 64948199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).