1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone

C18H17FO2 — CID 63531904

IUPAC1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone
SMILESCC(=O)c1cc(F)ccc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C18H17FO2/c1-12(20)17-11-15(19)7-9-18(17)21-16-8-6-13-4-2-3-5-14(13)10-16/h6-11H,2-5H2,1H3
InChIKeyJWZLACHPIGGMRP-UHFFFAOYSA-N
MW284.33 g/mol
LogP4.70
Rot. Bonds3

About 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone

1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone (PubChem CID 63531904) has the molecular formula C18H17FO2 and a molecular weight of 284.33 g/mol. Its IUPAC name is 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone.

Molecular Properties

Compound Name1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone
PubChem CID63531904
Molecular FormulaC18H17FO2
Molecular Weight284.33 g/mol
Exact Mass284.12
IUPAC Name1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone
SMILESCC(=O)c1cc(F)ccc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C18H17FO2/c1-12(20)17-11-15(19)7-9-18(17)21-16-8-6-13-4-2-3-5-14(13)10-16/h6-11H,2-5H2,1H3
InChIKeyJWZLACHPIGGMRP-UHFFFAOYSA-N
XLogP4.70
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-fluoro-2-(4-fluorophenoxy)phenyl]ethanone
CID 14797581
1-[2-(3-bromo-4-fluorophenoxy)-5-fluorophenyl]ethanone
CID 83234460
N-[3-fluoro-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]acetamide
CID 139760288
1-[5-fluoro-2-[4-(2-methoxyethyl)phenoxy]phenyl]ethanone
CID 43244939
1-[5-fluoro-2-[(6-methyl-3-pyridinyl)oxy]phenyl]ethanone
CID 62073432
1-[5-bromo-2-(4-fluorophenoxy)phenyl]ethanone
CID 82966681
4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)benzoic acid
CID 63513502
2-[2-(2,3-dihydro-1H-inden-5-yloxy)-5-fluorophenyl]ethanamine
CID 63803303
1-[5-fluoro-2-[2-(4-fluorophenoxy)ethoxy]phenyl]ethanone
CID 112787668
6-(4-fluoro-2-methylphenoxy)-3,4-dihydro-2H-naphthalen-1-one
CID 118598160
1-[2-(4-fluorophenoxy)phenyl]ethanone
CID 10633209
1-[5-fluoro-2-[3-(4-fluorophenoxy)propoxy]phenyl]ethanone
CID 112769767

Frequently Asked Questions

What is the IUPAC name of 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone?
The IUPAC name of 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone (CID 63531904) is 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone.
What is the SMILES notation for 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone?
The canonical SMILES for 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone is CC(=O)c1cc(F)ccc1Oc1ccc2c(c1)CCCC2.
What is the InChIKey of 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone?
The InChIKey is JWZLACHPIGGMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FO2/c1-12(20)17-11-15(19)7-9-18(17)21-16-8-6-13-4-2-3-5-14(13)10-16/h6-11H,2-5H2,1H3.
What are the key properties of 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone?
1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone has a molecular weight of 284.33 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-fluoro-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]ethanone is sourced from PubChem (CID 63531904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).