5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol

C17H17FO — CID 169410304

IUPAC5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCc1ccc(F)c(-c2cccc3c2CCCC3O)c1
InChIInChI=1S/C17H17FO/c1-11-8-9-16(18)15(10-11)13-4-2-6-14-12(13)5-3-7-17(14)19/h2,4,6,8-10,17,19H,3,5,7H2,1H3
InChIKeyGVYBIJHGHDMSDZ-UHFFFAOYSA-N
MW256.32 g/mol
LogP4.17
Rot. Bonds1

About 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol

5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 169410304) has the molecular formula C17H17FO and a molecular weight of 256.32 g/mol. Its IUPAC name is 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID169410304
Molecular FormulaC17H17FO
Molecular Weight256.32 g/mol
Exact Mass256.13
IUPAC Name5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCc1ccc(F)c(-c2cccc3c2CCCC3O)c1
InChIInChI=1S/C17H17FO/c1-11-8-9-16(18)15(10-11)13-4-2-6-14-12(13)5-3-7-17(14)19/h2,4,6,8-10,17,19H,3,5,7H2,1H3
InChIKeyGVYBIJHGHDMSDZ-UHFFFAOYSA-N
XLogP4.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol (CID 169410304) is 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol is Cc1ccc(F)c(-c2cccc3c2CCCC3O)c1.
What is the InChIKey of 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is GVYBIJHGHDMSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO/c1-11-8-9-16(18)15(10-11)13-4-2-6-14-12(13)5-3-7-17(14)19/h2,4,6,8-10,17,19H,3,5,7H2,1H3.
What are the key properties of 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol?
5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 256.32 g/mol, XLogP of 4.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 169410304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).