1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine

C16H24N2O2 — CID 103137197

IUPAC1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine
SMILESCC1CCC(COc2ccccc2N2CCNCC2)O1
InChIInChI=1S/C16H24N2O2/c1-13-6-7-14(20-13)12-19-16-5-3-2-4-15(16)18-10-8-17-9-11-18/h2-5,13-14,17H,6-12H2,1H3
InChIKeyJDLGKIFCBWYWJL-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.04
Rot. Bonds4

About 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine

1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine (PubChem CID 103137197) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine.

Molecular Properties

Compound Name1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine
PubChem CID103137197
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine
SMILESCC1CCC(COc2ccccc2N2CCNCC2)O1
InChIInChI=1S/C16H24N2O2/c1-13-6-7-14(20-13)12-19-16-5-3-2-4-15(16)18-10-8-17-9-11-18/h2-5,13-14,17H,6-12H2,1H3
InChIKeyJDLGKIFCBWYWJL-UHFFFAOYSA-N
XLogP2.04
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperidin-3-amine
CID 103137218
2-methyl-5-[(2-methylphenoxy)methyl]oxolane
CID 103141002
ethane;1-(2-ethoxyphenyl)piperazine
CID 142040905
2-[(5-methyloxolan-2-yl)methoxy]benzonitrile
CID 103134244
1-[2-(3-ethoxypropoxy)phenyl]-1,4-diazepane
CID 65181009
1-[2-(2-methylbutoxy)phenyl]-1,4-diazepane
CID 55037049
1-(2-octoxyphenyl)piperazine
CID 63461603
1-(2-ethoxyphenyl)-4-methyl-1,5-diazocane
CID 54973542
2-[(2-piperazin-1-ylphenoxy)methyl]pyrimidine
CID 62700527
2-(2-piperazin-1-ylphenoxy)ethanol;hydrobromide
CID 117067034
1-[2-(3-methylbut-2-enoxy)phenyl]piperazine
CID 114284672
N-[[2-[(5-methyloxolan-2-yl)methoxy]phenyl]methyl]cyclopropanamine
CID 103132821

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine?
The IUPAC name of 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine (CID 103137197) is 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine.
What is the SMILES notation for 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine?
The canonical SMILES for 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine is CC1CCC(COc2ccccc2N2CCNCC2)O1.
What is the InChIKey of 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine?
The InChIKey is JDLGKIFCBWYWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-13-6-7-14(20-13)12-19-16-5-3-2-4-15(16)18-10-8-17-9-11-18/h2-5,13-14,17H,6-12H2,1H3.
What are the key properties of 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine?
1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine has a molecular weight of 276.38 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine is sourced from PubChem (CID 103137197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).