1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine

C16H24N2O2 — CID 104707194

IUPAC1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine
SMILESCOc1ccc(OCC2CCC2)c(N2CCNCC2)c1
InChIInChI=1S/C16H24N2O2/c1-19-14-5-6-16(20-12-13-3-2-4-13)15(11-14)18-9-7-17-8-10-18/h5-6,11,13,17H,2-4,7-10,12H2,1H3
InChIKeyJHOXNWREVNQCPT-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.28
Rot. Bonds5

About 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine

1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine (PubChem CID 104707194) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine.

Molecular Properties

Compound Name1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine
PubChem CID104707194
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine
SMILESCOc1ccc(OCC2CCC2)c(N2CCNCC2)c1
InChIInChI=1S/C16H24N2O2/c1-19-14-5-6-16(20-12-13-3-2-4-13)15(11-14)18-9-7-17-8-10-18/h5-6,11,13,17H,2-4,7-10,12H2,1H3
InChIKeyJHOXNWREVNQCPT-UHFFFAOYSA-N
XLogP2.28
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-methoxy-2-(oxan-4-yloxy)phenyl]piperazine
CID 104707166
1-[4-(cyclobutylmethoxy)-3-methylphenyl]-1,4-diazepane
CID 65461450
1-(2-chloro-5-methoxyphenyl)piperazine
CID 18663028
2-(1,4-diazepan-1-yl)-4-methoxybenzonitrile
CID 81297511
1-(2,5-dimethoxyphenyl)-N-methylpiperidin-4-amine
CID 43315071
2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine
CID 61343767
4-[(4-methoxyphenoxy)methyl]piperidine;hydrochloride
CID 23724366
1-[2-[2-(cyclobutylmethoxy)-5-methylphenyl]ethyl]piperazine
CID 117466165
1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine
CID 43560073
1-[4-methoxy-2-(piperidin-3-ylmethyl)phenyl]piperidine
CID 117466204
1-[2-[4-(cyclopropylmethoxy)-3-methoxyphenyl]ethyl]piperazine
CID 117469441
3-cyclopropyl-1-(2,5-dimethoxyphenyl)piperazine
CID 64925366

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine?
The IUPAC name of 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine (CID 104707194) is 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine.
What is the SMILES notation for 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine?
The canonical SMILES for 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine is COc1ccc(OCC2CCC2)c(N2CCNCC2)c1.
What is the InChIKey of 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine?
The InChIKey is JHOXNWREVNQCPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-19-14-5-6-16(20-12-13-3-2-4-13)15(11-14)18-9-7-17-8-10-18/h5-6,11,13,17H,2-4,7-10,12H2,1H3.
What are the key properties of 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine?
1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine has a molecular weight of 276.38 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclobutylmethoxy)-5-methoxyphenyl]piperazine is sourced from PubChem (CID 104707194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).