3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol

C18H24O2 — CID 66366088

IUPAC3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol
SMILESOC1CC(OC2CCCc3ccccc32)C12CCCC2
InChIInChI=1S/C18H24O2/c19-16-12-17(18(16)10-3-4-11-18)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-2,6,8,15-17,19H,3-5,7,9-12H2
InChIKeyATNPKWFJEDPSHF-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.77
Rot. Bonds2

About 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol

3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol (PubChem CID 66366088) has the molecular formula C18H24O2 and a molecular weight of 272.39 g/mol. Its IUPAC name is 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol.

Molecular Properties

Compound Name3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol
PubChem CID66366088
Molecular FormulaC18H24O2
Molecular Weight272.39 g/mol
Exact Mass272.18
IUPAC Name3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol
SMILESOC1CC(OC2CCCc3ccccc32)C12CCCC2
InChIInChI=1S/C18H24O2/c19-16-12-17(18(16)10-3-4-11-18)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-2,6,8,15-17,19H,3-5,7,9-12H2
InChIKeyATNPKWFJEDPSHF-UHFFFAOYSA-N
XLogP3.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-ol
CID 66366089
N,2,2-trimethyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
CID 66357591
1-(3-chloro-2,2-diethylcyclobutyl)oxy-1,2,3,4-tetrahydronaphthalene
CID 66345937
N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
CID 66357997
N-(1,2,3,4-tetrahydronaphthalen-1-yloxy)methanimine
CID 174418938
1,2,3,4-tetrahydronaphthalen-1-ol
CID 10723
1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene
CID 43135615
2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)oxane
CID 11085661
2-methoxy-N-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclobutan-1-amine
CID 104674500
3-phenylmethoxyspiro[3.5]nonan-1-ol
CID 66366074
(1R)-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1,2,3,4-tetrahydronaphthalene
CID 101156511
3-[(2-bromophenyl)methoxy]spiro[3.6]decan-1-ol
CID 82826223

Frequently Asked Questions

What is the IUPAC name of 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol?
The IUPAC name of 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol (CID 66366088) is 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol.
What is the SMILES notation for 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol?
The canonical SMILES for 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol is OC1CC(OC2CCCc3ccccc32)C12CCCC2.
What is the InChIKey of 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol?
The InChIKey is ATNPKWFJEDPSHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O2/c19-16-12-17(18(16)10-3-4-11-18)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-2,6,8,15-17,19H,3-5,7,9-12H2.
What are the key properties of 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol?
3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol has a molecular weight of 272.39 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)spiro[3.4]octan-1-ol is sourced from PubChem (CID 66366088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).