1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine

C15H22N2O — CID 54914447

IUPAC1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine
SMILESCOc1ccc2c(c1)CCCC2N1CCNCC1
InChIInChI=1S/C15H22N2O/c1-18-13-5-6-14-12(11-13)3-2-4-15(14)17-9-7-16-8-10-17/h5-6,11,15-16H,2-4,7-10H2,1H3
InChIKeyLVKJITASZUWOSD-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.98
Rot. Bonds2

About 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine

1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine (PubChem CID 54914447) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine.

Molecular Properties

Compound Name1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine
PubChem CID54914447
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine
SMILESCOc1ccc2c(c1)CCCC2N1CCNCC1
InChIInChI=1S/C15H22N2O/c1-18-13-5-6-14-12(11-13)3-2-4-15(14)17-9-7-16-8-10-17/h5-6,11,15-16H,2-4,7-10H2,1H3
InChIKeyLVKJITASZUWOSD-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[7-(deuteriomethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]piperazine;ethane
CID 91603209
(4aS,7aS)-6-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678805
(11bS)-9-methoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
CID 67568151
2-[1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)azetidin-3-yl]acetic acid
CID 65069242
[1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidin-2-yl]methanamine
CID 103440758
1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2,5-dimethylpiperazine
CID 64979039
1-[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,4-diazepane
CID 141010316
(2R,11bS)-9-methoxy-N-methyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-amine
CID 67567262
5-methoxy-1-methyl-3-piperazin-1-yl-2,3-dihydroindole
CID 82023787
1-[6-(2-pyrrolidin-1-ylethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine
CID 24771157
1-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,5-diazocane
CID 62316741
(5S,11R)-3-chloro-9-methoxy-5-piperazin-1-yl-5,6-dihydrobenzo[b][1]benzothiepine 11-oxide
CID 92967246

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine?
The IUPAC name of 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine (CID 54914447) is 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine.
What is the SMILES notation for 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine?
The canonical SMILES for 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine is COc1ccc2c(c1)CCCC2N1CCNCC1.
What is the InChIKey of 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine?
The InChIKey is LVKJITASZUWOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-18-13-5-6-14-12(11-13)3-2-4-15(14)17-9-7-16-8-10-17/h5-6,11,15-16H,2-4,7-10H2,1H3.
What are the key properties of 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine?
1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine has a molecular weight of 246.35 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)piperazine is sourced from PubChem (CID 54914447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).