(2S)-2-(2-fluoroethyl)cyclopentan-1-one

C7H11FO — CID 97052906

IUPAC(2S)-2-(2-fluoroethyl)cyclopentan-1-one
SMILESO=C1CCC[C@H]1CCF
InChIInChI=1S/C7H11FO/c8-5-4-6-2-1-3-7(6)9/h6H,1-5H2/t6-/m0/s1
InChIKeyHPPBWMDYOWOEOX-LURJTMIESA-N
MW130.16 g/mol
LogP1.72
Rot. Bonds2

About (2S)-2-(2-fluoroethyl)cyclopentan-1-one

(2S)-2-(2-fluoroethyl)cyclopentan-1-one (PubChem CID 97052906) has the molecular formula C7H11FO and a molecular weight of 130.16 g/mol. Its IUPAC name is (2S)-2-(2-fluoroethyl)cyclopentan-1-one.

Molecular Properties

Compound Name(2S)-2-(2-fluoroethyl)cyclopentan-1-one
PubChem CID97052906
Molecular FormulaC7H11FO
Molecular Weight130.16 g/mol
Exact Mass130.08
IUPAC Name(2S)-2-(2-fluoroethyl)cyclopentan-1-one
SMILESO=C1CCC[C@H]1CCF
InChIInChI=1S/C7H11FO/c8-5-4-6-2-1-3-7(6)9/h6H,1-5H2/t6-/m0/s1
InChIKeyHPPBWMDYOWOEOX-LURJTMIESA-N
XLogP1.72
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.16
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-decylcyclopentan-1-one
CID 12823821
2-butylcyclopentan-1-one;methanamine
CID 174247706
2-[(E)-4-(2-oxocyclopentyl)but-2-enyl]cyclopentan-1-one
CID 166722235
2-butylcyclopentan-1-one;N,N-dimethylmethanamine
CID 145289923
2-(2-ethenoxyethyl)cyclopentan-1-one
CID 10606978
2-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]cyclopentan-1-one
CID 79570038
2-(5,5-dimethylhexyl)cyclopentan-1-one
CID 90715484
2-(3-ethoxypropyl)cyclopentan-1-one
CID 65180867
(2R)-2-[[(1R)-2-oxocyclohexyl]methyl]cyclohexan-1-one
CID 915648
(2S)-2-(3-methylbutyl)cyclohexan-1-one
CID 101110174
2-(3-methylbutyl)cyclohexan-1-one
CID 12840280
2-(aminomethyl)cycloheptan-1-one
CID 84731152

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-fluoroethyl)cyclopentan-1-one?
The IUPAC name of (2S)-2-(2-fluoroethyl)cyclopentan-1-one (CID 97052906) is (2S)-2-(2-fluoroethyl)cyclopentan-1-one.
What is the SMILES notation for (2S)-2-(2-fluoroethyl)cyclopentan-1-one?
The canonical SMILES for (2S)-2-(2-fluoroethyl)cyclopentan-1-one is O=C1CCC[C@H]1CCF.
What is the InChIKey of (2S)-2-(2-fluoroethyl)cyclopentan-1-one?
The InChIKey is HPPBWMDYOWOEOX-LURJTMIESA-N. The full InChI is InChI=1S/C7H11FO/c8-5-4-6-2-1-3-7(6)9/h6H,1-5H2/t6-/m0/s1.
What are the key properties of (2S)-2-(2-fluoroethyl)cyclopentan-1-one?
(2S)-2-(2-fluoroethyl)cyclopentan-1-one has a molecular weight of 130.16 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-fluoroethyl)cyclopentan-1-one is sourced from PubChem (CID 97052906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).