(3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one

C7H11FO3 — CID 163515231

IUPAC(3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one
SMILESCOCC1C[C@@](C)(F)C(=O)O1
InChIInChI=1S/C7H11FO3/c1-7(8)3-5(4-10-2)11-6(7)9/h5H,3-4H2,1-2H3/t5?,7-/m1/s1
InChIKeyDGCNYCSLRPDTLF-NQPNHJOESA-N
MW162.16 g/mol
LogP0.68
Rot. Bonds2

About (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one

(3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one (PubChem CID 163515231) has the molecular formula C7H11FO3 and a molecular weight of 162.16 g/mol. Its IUPAC name is (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one.

Molecular Properties

Compound Name(3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one
PubChem CID163515231
Molecular FormulaC7H11FO3
Molecular Weight162.16 g/mol
Exact Mass162.07
IUPAC Name(3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one
SMILESCOCC1C[C@@](C)(F)C(=O)O1
InChIInChI=1S/C7H11FO3/c1-7(8)3-5(4-10-2)11-6(7)9/h5H,3-4H2,1-2H3/t5?,7-/m1/s1
InChIKeyDGCNYCSLRPDTLF-NQPNHJOESA-N
XLogP0.68
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.16
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one?
The IUPAC name of (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one (CID 163515231) is (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one.
What is the SMILES notation for (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one?
The canonical SMILES for (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one is COCC1C[C@@](C)(F)C(=O)O1.
What is the InChIKey of (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one?
The InChIKey is DGCNYCSLRPDTLF-NQPNHJOESA-N. The full InChI is InChI=1S/C7H11FO3/c1-7(8)3-5(4-10-2)11-6(7)9/h5H,3-4H2,1-2H3/t5?,7-/m1/s1.
What are the key properties of (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one?
(3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one has a molecular weight of 162.16 g/mol, XLogP of 0.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-fluoro-5-(methoxymethyl)-3-methyloxolan-2-one is sourced from PubChem (CID 163515231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).