3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine

C15H22N2O2 — CID 64925366

IUPAC3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine
SMILESCOc1ccc(OC)c(N2CCNC(C3CC3)C2)c1
InChIInChI=1S/C15H22N2O2/c1-18-12-5-6-15(19-2)14(9-12)17-8-7-16-13(10-17)11-3-4-11/h5-6,9,11,13,16H,3-4,7-8,10H2,1-2H3
InChIKeyHVVLAHQXCXXVMY-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.89
Rot. Bonds4

About 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine

3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine (PubChem CID 64925366) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine.

Molecular Properties

Compound Name3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine
PubChem CID64925366
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine
SMILESCOc1ccc(OC)c(N2CCNC(C3CC3)C2)c1
InChIInChI=1S/C15H22N2O2/c1-18-12-5-6-15(19-2)14(9-12)17-8-7-16-13(10-17)11-3-4-11/h5-6,9,11,13,16H,3-4,7-8,10H2,1-2H3
InChIKeyHVVLAHQXCXXVMY-UHFFFAOYSA-N
XLogP1.89
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-1-(2,4-dimethoxyphenyl)piperazine
CID 64924196
5-cyclopropyl-1-(2,5-dimethoxyphenyl)-2-methylpiperazine
CID 64932759
6-(2,5-dimethoxyphenyl)-4a,5,7,7a-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,4-dione
CID 23052978
1-(2,5-dimethoxyphenyl)-N-methylpiperidin-4-amine
CID 43315071
3-cyclopropyl-1-[2-(methoxymethyl)phenyl]piperazine
CID 64926120
3-butan-2-yl-1-(2,5-dimethoxyphenyl)-1,4-diazepane
CID 64942271
[4-(2,4-dimethoxyphenyl)piperazin-2-yl]methanamine
CID 117026870
1-(2,5-dimethoxyphenyl)-2-methylpiperazine
CID 64938786
N-[[1-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]methyl]ethanamine
CID 54792843
2-[[1-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]amino]acetonitrile
CID 117004681
3-cyclopropyl-1-[(2-methoxy-5-methylphenyl)methyl]piperazine
CID 64832813
1-[1-(2,5-dimethoxyphenyl)pyrrolidin-3-yl]butan-1-one
CID 83981268

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine?
The IUPAC name of 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine (CID 64925366) is 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine.
What is the SMILES notation for 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine?
The canonical SMILES for 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine is COc1ccc(OC)c(N2CCNC(C3CC3)C2)c1.
What is the InChIKey of 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine?
The InChIKey is HVVLAHQXCXXVMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-18-12-5-6-15(19-2)14(9-12)17-8-7-16-13(10-17)11-3-4-11/h5-6,9,11,13,16H,3-4,7-8,10H2,1-2H3.
What are the key properties of 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine?
3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine has a molecular weight of 262.35 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine is sourced from PubChem (CID 64925366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).