1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol

C13H17FO — CID 65049665

IUPAC1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol
SMILESCc1ccc(F)cc1C1(O)CCCC1C
InChIInChI=1S/C13H17FO/c1-9-5-6-11(14)8-12(9)13(15)7-3-4-10(13)2/h5-6,8,10,15H,3-4,7H2,1-2H3
InChIKeyYKVZAEURLKVGPT-UHFFFAOYSA-N
MW208.28 g/mol
LogP3.14
Rot. Bonds1

About 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol

1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol (PubChem CID 65049665) has the molecular formula C13H17FO and a molecular weight of 208.28 g/mol. Its IUPAC name is 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol.

Molecular Properties

Compound Name1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol
PubChem CID65049665
Molecular FormulaC13H17FO
Molecular Weight208.28 g/mol
Exact Mass208.13
IUPAC Name1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol
SMILESCc1ccc(F)cc1C1(O)CCCC1C
InChIInChI=1S/C13H17FO/c1-9-5-6-11(14)8-12(9)13(15)7-3-4-10(13)2/h5-6,8,10,15H,3-4,7H2,1-2H3
InChIKeyYKVZAEURLKVGPT-UHFFFAOYSA-N
XLogP3.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol?
The IUPAC name of 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol (CID 65049665) is 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol.
What is the SMILES notation for 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol?
The canonical SMILES for 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol is Cc1ccc(F)cc1C1(O)CCCC1C.
What is the InChIKey of 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol?
The InChIKey is YKVZAEURLKVGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FO/c1-9-5-6-11(14)8-12(9)13(15)7-3-4-10(13)2/h5-6,8,10,15H,3-4,7H2,1-2H3.
What are the key properties of 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol?
1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol has a molecular weight of 208.28 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol is sourced from PubChem (CID 65049665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).