2-cyclopentyl-4-fluoro-1-methoxybenzene

C12H15FO — CID 67457026

IUPAC2-cyclopentyl-4-fluoro-1-methoxybenzene
SMILESCOc1ccc(F)cc1C1CCCC1
InChIInChI=1S/C12H15FO/c1-14-12-7-6-10(13)8-11(12)9-4-2-3-5-9/h6-9H,2-5H2,1H3
InChIKeyGDLGVBNXPGHZRH-UHFFFAOYSA-N
MW194.25 g/mol
LogP3.49
Rot. Bonds2

About 2-cyclopentyl-4-fluoro-1-methoxybenzene

2-cyclopentyl-4-fluoro-1-methoxybenzene (PubChem CID 67457026) has the molecular formula C12H15FO and a molecular weight of 194.25 g/mol. Its IUPAC name is 2-cyclopentyl-4-fluoro-1-methoxybenzene.

Molecular Properties

Compound Name2-cyclopentyl-4-fluoro-1-methoxybenzene
PubChem CID67457026
Molecular FormulaC12H15FO
Molecular Weight194.25 g/mol
Exact Mass194.11
IUPAC Name2-cyclopentyl-4-fluoro-1-methoxybenzene
SMILESCOc1ccc(F)cc1C1CCCC1
InChIInChI=1S/C12H15FO/c1-14-12-7-6-10(13)8-11(12)9-4-2-3-5-9/h6-9H,2-5H2,1H3
InChIKeyGDLGVBNXPGHZRH-UHFFFAOYSA-N
XLogP3.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-4-fluoro-1-methoxybenzene?
The IUPAC name of 2-cyclopentyl-4-fluoro-1-methoxybenzene (CID 67457026) is 2-cyclopentyl-4-fluoro-1-methoxybenzene.
What is the SMILES notation for 2-cyclopentyl-4-fluoro-1-methoxybenzene?
The canonical SMILES for 2-cyclopentyl-4-fluoro-1-methoxybenzene is COc1ccc(F)cc1C1CCCC1.
What is the InChIKey of 2-cyclopentyl-4-fluoro-1-methoxybenzene?
The InChIKey is GDLGVBNXPGHZRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO/c1-14-12-7-6-10(13)8-11(12)9-4-2-3-5-9/h6-9H,2-5H2,1H3.
What are the key properties of 2-cyclopentyl-4-fluoro-1-methoxybenzene?
2-cyclopentyl-4-fluoro-1-methoxybenzene has a molecular weight of 194.25 g/mol, XLogP of 3.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-4-fluoro-1-methoxybenzene is sourced from PubChem (CID 67457026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).