1-fluoro-3-methoxycyclopentane

C6H11FO — CID 174947767

IUPAC1-fluoro-3-methoxycyclopentane
SMILESCOC1CCC(F)C1
InChIInChI=1S/C6H11FO/c1-8-6-3-2-5(7)4-6/h5-6H,2-4H2,1H3
InChIKeyNDGSKKNSBXYRQO-UHFFFAOYSA-N
MW118.15 g/mol
LogP1.52
Rot. Bonds1

About 1-fluoro-3-methoxycyclopentane

1-fluoro-3-methoxycyclopentane (PubChem CID 174947767) has the molecular formula C6H11FO and a molecular weight of 118.15 g/mol. Its IUPAC name is 1-fluoro-3-methoxycyclopentane.

Molecular Properties

Compound Name1-fluoro-3-methoxycyclopentane
PubChem CID174947767
Molecular FormulaC6H11FO
Molecular Weight118.15 g/mol
Exact Mass118.08
IUPAC Name1-fluoro-3-methoxycyclopentane
SMILESCOC1CCC(F)C1
InChIInChI=1S/C6H11FO/c1-8-6-3-2-5(7)4-6/h5-6H,2-4H2,1H3
InChIKeyNDGSKKNSBXYRQO-UHFFFAOYSA-N
XLogP1.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.15
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-methoxycyclopentane?
The IUPAC name of 1-fluoro-3-methoxycyclopentane (CID 174947767) is 1-fluoro-3-methoxycyclopentane.
What is the SMILES notation for 1-fluoro-3-methoxycyclopentane?
The canonical SMILES for 1-fluoro-3-methoxycyclopentane is COC1CCC(F)C1.
What is the InChIKey of 1-fluoro-3-methoxycyclopentane?
The InChIKey is NDGSKKNSBXYRQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FO/c1-8-6-3-2-5(7)4-6/h5-6H,2-4H2,1H3.
What are the key properties of 1-fluoro-3-methoxycyclopentane?
1-fluoro-3-methoxycyclopentane has a molecular weight of 118.15 g/mol, XLogP of 1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-methoxycyclopentane is sourced from PubChem (CID 174947767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).