1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene

C14H19FO2 — CID 21162814

IUPAC1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene
SMILESCCOC1CCCC1OCc1ccccc1F
InChIInChI=1S/C14H19FO2/c1-2-16-13-8-5-9-14(13)17-10-11-6-3-4-7-12(11)15/h3-4,6-7,13-14H,2,5,8-10H2,1H3
InChIKeyFNJNUBNIIFJSOU-UHFFFAOYSA-N
MW238.30 g/mol
LogP3.30
Rot. Bonds5

About 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene

1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene (PubChem CID 21162814) has the molecular formula C14H19FO2 and a molecular weight of 238.30 g/mol. Its IUPAC name is 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene.

Molecular Properties

Compound Name1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene
PubChem CID21162814
Molecular FormulaC14H19FO2
Molecular Weight238.30 g/mol
Exact Mass238.14
IUPAC Name1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene
SMILESCCOC1CCCC1OCc1ccccc1F
InChIInChI=1S/C14H19FO2/c1-2-16-13-8-5-9-14(13)17-10-11-6-3-4-7-12(11)15/h3-4,6-7,13-14H,2,5,8-10H2,1H3
InChIKeyFNJNUBNIIFJSOU-UHFFFAOYSA-N
XLogP3.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.30
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-3-[(2-fluorophenyl)methoxy]-N-propylcyclobutan-1-amine
CID 104676522
ethyl 3-[(2-fluorophenyl)methoxy]-4-iodocyclopentane-1-carboxylate
CID 114774198
2-[(2-fluorophenyl)methoxy]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420186
2-[(2-fluorophenyl)methoxy]cyclohexan-1-one
CID 13476787
1-(cyclobutylmethyl)-2-fluorobenzene
CID 89050192
(2-phenylmethoxycyclopentyl)oxymethylbenzene
CID 14085268
(2S,4R,5R)-5-[(2-fluorophenyl)methoxy]-4-methyl-2-propyl-1,3-dioxane
CID 70593028
(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine
CID 66520009
3-[(2-fluorophenyl)methoxy]pyrrolidine
CID 14497371
3-[(2-fluorophenyl)methoxy]-N-methylspiro[3.4]octan-1-amine
CID 66353126
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
2,2-diethyl-3-[(2-fluorophenyl)methoxy]cyclobutan-1-ol
CID 66344808

Frequently Asked Questions

What is the IUPAC name of 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene?
The IUPAC name of 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene (CID 21162814) is 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene.
What is the SMILES notation for 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene?
The canonical SMILES for 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene is CCOC1CCCC1OCc1ccccc1F.
What is the InChIKey of 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene?
The InChIKey is FNJNUBNIIFJSOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FO2/c1-2-16-13-8-5-9-14(13)17-10-11-6-3-4-7-12(11)15/h3-4,6-7,13-14H,2,5,8-10H2,1H3.
What are the key properties of 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene?
1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene has a molecular weight of 238.30 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-ethoxycyclopentyl)oxymethyl]-2-fluorobenzene is sourced from PubChem (CID 21162814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).