2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol

C16H22O3 — CID 104675407

IUPAC2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol
SMILESCCOC1C(O)CC1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H22O3/c1-2-18-16-14(17)10-15(16)19-13-8-7-11-5-3-4-6-12(11)9-13/h7-9,14-17H,2-6,10H2,1H3
InChIKeyMKPIGOGCZUBEMH-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.48
Rot. Bonds4

About 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol

2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol (PubChem CID 104675407) has the molecular formula C16H22O3 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol.

Molecular Properties

Compound Name2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol
PubChem CID104675407
Molecular FormulaC16H22O3
Molecular Weight262.35 g/mol
Exact Mass262.16
IUPAC Name2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol
SMILESCCOC1C(O)CC1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H22O3/c1-2-18-16-14(17)10-15(16)19-13-8-7-11-5-3-4-6-12(11)9-13/h7-9,14-17H,2-6,10H2,1H3
InChIKeyMKPIGOGCZUBEMH-UHFFFAOYSA-N
XLogP2.48
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-one
CID 104675191
4-ethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclohexan-1-ol
CID 63465955
3-(4-chloro-3-methylphenoxy)-2-ethoxycyclobutan-1-ol
CID 113439889
trans-(1R,2R)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclopentan-1-ol
CID 102735479
2-ethoxy-3-(3-propan-2-ylphenoxy)cyclobutan-1-ol
CID 104675275
2-(2,3-dihydro-1H-inden-5-yloxy)-4-propylcyclohexan-1-ol
CID 63466658
2-ethoxy-3-[4-(2-methylbutan-2-yl)phenoxy]cyclobutan-1-ol
CID 104675287
2,2-dimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol
CID 66346470
6-(2,3-dihydro-1H-inden-5-yloxy)-2,2-dimethylcyclohexan-1-ol
CID 79846941
4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclohexan-1-amine
CID 61398789
3-(2,3-dihydro-1H-inden-5-yloxy)-2-propoxycyclobutan-1-one
CID 114018813
[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclopentyl]methanamine
CID 82239829

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol?
The IUPAC name of 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol (CID 104675407) is 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol.
What is the SMILES notation for 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol?
The canonical SMILES for 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol is CCOC1C(O)CC1Oc1ccc2c(c1)CCCC2.
What is the InChIKey of 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol?
The InChIKey is MKPIGOGCZUBEMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O3/c1-2-18-16-14(17)10-15(16)19-13-8-7-11-5-3-4-6-12(11)9-13/h7-9,14-17H,2-6,10H2,1H3.
What are the key properties of 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol?
2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol has a molecular weight of 262.35 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)cyclobutan-1-ol is sourced from PubChem (CID 104675407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).