3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine

C15H22N2O — CID 64926120

IUPAC3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine
SMILESCOCc1ccccc1N1CCNC(C2CC2)C1
InChIInChI=1S/C15H22N2O/c1-18-11-13-4-2-3-5-15(13)17-9-8-16-14(10-17)12-6-7-12/h2-5,12,14,16H,6-11H2,1H3
InChIKeyYLMHYQBRTFUSFD-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.02
Rot. Bonds4

About 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine

3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine (PubChem CID 64926120) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine.

Molecular Properties

Compound Name3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine
PubChem CID64926120
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine
SMILESCOCc1ccccc1N1CCNC(C2CC2)C1
InChIInChI=1S/C15H22N2O/c1-18-11-13-4-2-3-5-15(13)17-9-8-16-14(10-17)12-6-7-12/h2-5,12,14,16H,6-11H2,1H3
InChIKeyYLMHYQBRTFUSFD-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(methoxymethyl)phenyl]-3-methylpiperazine
CID 64925935
1-[2-(methoxymethyl)phenyl]-3-propylpiperazine
CID 64925936
5-[2-(methoxymethyl)phenyl]-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 155345672
[1-[2-(methoxymethyl)phenyl]pyrrolidin-3-yl]methanol
CID 64865830
1-(2-bromophenyl)-3-cyclohexylpiperazine
CID 64926277
3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine
CID 64925366
3-cyclopropyl-1-(2,4-dimethoxyphenyl)piperazine
CID 64924196
3-cyclopropyl-1-(2-fluorophenyl)-1,4-diazepane
CID 64943298
3-cyclopropyl-1-(2-methylsulfanylphenyl)-1,4-diazepane
CID 107646320
1-(3-bromo-2-methylphenyl)-3-cyclohexylpiperazine
CID 107639855
1-benzyl-4-[2-(methoxymethyl)phenyl]piperazine;1-[2-(methoxymethyl)phenyl]piperazine
CID 159879194
3-cyclohexyl-1-(2,3-difluorophenyl)piperazine
CID 64924730

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine?
The IUPAC name of 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine (CID 64926120) is 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine.
What is the SMILES notation for 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine?
The canonical SMILES for 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine is COCc1ccccc1N1CCNC(C2CC2)C1.
What is the InChIKey of 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine?
The InChIKey is YLMHYQBRTFUSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-18-11-13-4-2-3-5-15(13)17-9-8-16-14(10-17)12-6-7-12/h2-5,12,14,16H,6-11H2,1H3.
What are the key properties of 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine?
3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine has a molecular weight of 246.35 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine is sourced from PubChem (CID 64926120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).