1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane

C12H21FO — CID 168880888

IUPAC1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane
SMILESC=CCC[C@@H](F)C1(COC)CCCC1
InChIInChI=1S/C12H21FO/c1-3-4-7-11(13)12(10-14-2)8-5-6-9-12/h3,11H,1,4-10H2,2H3/t11-/m1/s1
InChIKeyIOGMVRQXFNKWPR-LLVKDONJSA-N
MW200.30 g/mol
LogP3.50
Rot. Bonds6

About 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane

1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane (PubChem CID 168880888) has the molecular formula C12H21FO and a molecular weight of 200.30 g/mol. Its IUPAC name is 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane.

Molecular Properties

Compound Name1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane
PubChem CID168880888
Molecular FormulaC12H21FO
Molecular Weight200.30 g/mol
Exact Mass200.16
IUPAC Name1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane
SMILESC=CCC[C@@H](F)C1(COC)CCCC1
InChIInChI=1S/C12H21FO/c1-3-4-7-11(13)12(10-14-2)8-5-6-9-12/h3,11H,1,4-10H2,2H3/t11-/m1/s1
InChIKeyIOGMVRQXFNKWPR-LLVKDONJSA-N
XLogP3.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.30
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane?
The IUPAC name of 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane (CID 168880888) is 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane.
What is the SMILES notation for 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane?
The canonical SMILES for 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane is C=CCC[C@@H](F)C1(COC)CCCC1.
What is the InChIKey of 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane?
The InChIKey is IOGMVRQXFNKWPR-LLVKDONJSA-N. The full InChI is InChI=1S/C12H21FO/c1-3-4-7-11(13)12(10-14-2)8-5-6-9-12/h3,11H,1,4-10H2,2H3/t11-/m1/s1.
What are the key properties of 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane?
1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane has a molecular weight of 200.30 g/mol, XLogP of 3.50, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-fluoropent-4-enyl]-1-(methoxymethyl)cyclopentane is sourced from PubChem (CID 168880888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).