1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine

C15H24N2O2 — CID 117415778

IUPAC1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine
SMILESCOCc1ccc(OC)c(CCN2CCNCC2)c1
InChIInChI=1S/C15H24N2O2/c1-18-12-13-3-4-15(19-2)14(11-13)5-8-17-9-6-16-7-10-17/h3-4,11,16H,5-10,12H2,1-2H3
InChIKeyTVVLFCAUGKNOHF-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.29
Rot. Bonds6

About 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine

1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine (PubChem CID 117415778) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine.

Molecular Properties

Compound Name1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine
PubChem CID117415778
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine
SMILESCOCc1ccc(OC)c(CCN2CCNCC2)c1
InChIInChI=1S/C15H24N2O2/c1-18-12-13-3-4-15(19-2)14(11-13)5-8-17-9-6-16-7-10-17/h3-4,11,16H,5-10,12H2,1-2H3
InChIKeyTVVLFCAUGKNOHF-UHFFFAOYSA-N
XLogP1.29
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[2-methoxy-5-(methoxymethyl)phenyl]methyl]piperazine
CID 117379704
1-[2-(2-methoxy-5-methylphenyl)ethyl]piperazine
CID 82083196
1-[2-[4,5-dimethoxy-2-(methoxymethyl)phenyl]ethyl]piperazine
CID 117475075
4-methoxy-N,N-dimethyl-3-(2-piperazin-1-ylethyl)aniline
CID 117413761
1-[2-(2-methoxyphenyl)ethyl]piperazine;dihydrochloride
CID 52983547
2-methoxy-5-(2-piperazin-1-ylethyl)phenol
CID 83294637
1-[2-[3-chloro-2-fluoro-5-(methoxymethyl)phenyl]ethyl]piperazine
CID 117462551
4-(methoxymethyl)-2-(piperazin-1-ylmethyl)phenol
CID 83897174
1-[2-(4-chloro-2-methoxy-5-methylphenyl)ethyl]piperazine
CID 82551173
1-[2-[(3-fluoro-4-methoxyphenyl)methoxy]ethyl]piperazine
CID 98018148
1-[2-[4-chloro-2-methoxy-6-(methoxymethyl)phenyl]ethyl]piperazine
CID 117481365
1-[2-(3-ethyl-2,4-dimethoxyphenyl)ethyl]piperazine
CID 117446670

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine?
The IUPAC name of 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine (CID 117415778) is 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine.
What is the SMILES notation for 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine?
The canonical SMILES for 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine is COCc1ccc(OC)c(CCN2CCNCC2)c1.
What is the InChIKey of 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine?
The InChIKey is TVVLFCAUGKNOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-18-12-13-3-4-15(19-2)14(11-13)5-8-17-9-6-16-7-10-17/h3-4,11,16H,5-10,12H2,1-2H3.
What are the key properties of 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine?
1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine has a molecular weight of 264.37 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-methoxy-5-(methoxymethyl)phenyl]ethyl]piperazine is sourced from PubChem (CID 117415778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).