(2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone

C7H7FO3 — CID 162417007

IUPAC(2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone
SMILESCO[C@H]([18F])C(=O)c1ccco1
InChIInChI=1S/C7H7FO3/c1-10-7(8)6(9)5-3-2-4-11-5/h2-4,7H,1H3/t7-/m0/s1/i8-1
InChIKeyAYWJTMJQHHTLKP-CGLODTDKSA-N
MW157.13 g/mol
LogP1.40
Rot. Bonds3

About (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone

(2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone (PubChem CID 162417007) has the molecular formula C7H7FO3 and a molecular weight of 157.13 g/mol. Its IUPAC name is (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone.

Molecular Properties

Compound Name(2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone
PubChem CID162417007
Molecular FormulaC7H7FO3
Molecular Weight157.13 g/mol
Exact Mass157.04
IUPAC Name(2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone
SMILESCO[C@H]([18F])C(=O)c1ccco1
InChIInChI=1S/C7H7FO3/c1-10-7(8)6(9)5-3-2-4-11-5/h2-4,7H,1H3/t7-/m0/s1/i8-1
InChIKeyAYWJTMJQHHTLKP-CGLODTDKSA-N
XLogP1.40
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.13
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-bis(furan-2-yl)-2-methylpropane-1,3-dione
CID 15262340
1,4-bis(furan-2-yl)-2,3-dihydroxybutane-1,4-dione
CID 121014452
furan-2-yl(phosphanyl)methanone
CID 151549332
2-ethyl-1-(furan-2-yl)butan-1-one
CID 14709528
3-(furan-2-yl)-2-hydroxy-3-oxopropanal
CID 174854524
2-bromo-1-(furan-2-yl)butan-1-one
CID 45081165
methyl (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetate
CID 87793315
furan-2-carboxylic acid;methanol
CID 70611195
ethyl (3S)-4-(furan-2-yl)-3-methyl-4-oxobutanoate
CID 134968543
ethyl 2-(furan-2-carbonyl)-3-oxobutanoate
CID 2759235
methane;propan-2-yl furan-2-carboxylate
CID 157166715
methyl 3-(furan-2-yl)-3-oxo-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanoate
CID 122388239

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone?
The IUPAC name of (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone (CID 162417007) is (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone.
What is the SMILES notation for (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone?
The canonical SMILES for (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone is CO[C@H]([18F])C(=O)c1ccco1.
What is the InChIKey of (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone?
The InChIKey is AYWJTMJQHHTLKP-CGLODTDKSA-N. The full InChI is InChI=1S/C7H7FO3/c1-10-7(8)6(9)5-3-2-4-11-5/h2-4,7H,1H3/t7-/m0/s1/i8-1.
What are the key properties of (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone?
(2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone has a molecular weight of 157.13 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(18F)fluoro-1-(furan-2-yl)-2-methoxyethanone is sourced from PubChem (CID 162417007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).