2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine

C17H25NO — CID 55242275

IUPAC2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine
SMILESCC1CCC(OCC2CCCc3ccccc32)CN1
InChIInChI=1S/C17H25NO/c1-13-9-10-16(11-18-13)19-12-15-7-4-6-14-5-2-3-8-17(14)15/h2-3,5,8,13,15-16,18H,4,6-7,9-12H2,1H3
InChIKeyDYAAZXQJOUGCAE-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.26
Rot. Bonds3

About 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine

2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine (PubChem CID 55242275) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine.

Molecular Properties

Compound Name2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine
PubChem CID55242275
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine
SMILESCC1CCC(OCC2CCCc3ccccc32)CN1
InChIInChI=1S/C17H25NO/c1-13-9-10-16(11-18-13)19-12-15-7-4-6-14-5-2-3-8-17(14)15/h2-3,5,8,13,15-16,18H,4,6-7,9-12H2,1H3
InChIKeyDYAAZXQJOUGCAE-UHFFFAOYSA-N
XLogP3.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)cyclohexane-1-carboxylic acid
CID 114450996
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
4-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxymethyl)piperidine
CID 63771604
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
1-[(2,6-dimethylphenoxy)methyl]-1,2,3,4-tetrahydronaphthalene
CID 83056818
3-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperazine
CID 64833584
1-(bromomethyl)-1,2,3,4-tetrahydronaphthalene
CID 13067239
1-(iodomethyl)-1,2,3,4-tetrahydronaphthalene
CID 2763030
3-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclobutan-1-amine
CID 103917323
N-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)aniline
CID 63771297
3-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxymethyl)pentan-3-amine
CID 64573367
4-(1,2,3,4-tetrahydronaphthalen-1-ylmethylsulfanyl)butan-2-amine
CID 66233726

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine?
The IUPAC name of 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine (CID 55242275) is 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine.
What is the SMILES notation for 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine?
The canonical SMILES for 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine is CC1CCC(OCC2CCCc3ccccc32)CN1.
What is the InChIKey of 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine?
The InChIKey is DYAAZXQJOUGCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-13-9-10-16(11-18-13)19-12-15-7-4-6-14-5-2-3-8-17(14)15/h2-3,5,8,13,15-16,18H,4,6-7,9-12H2,1H3.
What are the key properties of 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine?
2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine has a molecular weight of 259.39 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylmethoxy)piperidine is sourced from PubChem (CID 55242275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).