1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one

C8H10O3 — CID 15504484

IUPAC1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one
SMILESCC(C)(O)C(=O)c1ccoc1
InChIInChI=1S/C8H10O3/c1-8(2,10)7(9)6-3-4-11-5-6/h3-5,10H,1-2H3
InChIKeyCKPPHRMMGIJYTC-UHFFFAOYSA-N
MW154.16 g/mol
LogP1.23
Rot. Bonds2

About 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one

1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one (PubChem CID 15504484) has the molecular formula C8H10O3 and a molecular weight of 154.16 g/mol. Its IUPAC name is 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one.

Molecular Properties

Compound Name1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one
PubChem CID15504484
Molecular FormulaC8H10O3
Molecular Weight154.16 g/mol
Exact Mass154.06
IUPAC Name1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one
SMILESCC(C)(O)C(=O)c1ccoc1
InChIInChI=1S/C8H10O3/c1-8(2,10)7(9)6-3-4-11-5-6/h3-5,10H,1-2H3
InChIKeyCKPPHRMMGIJYTC-UHFFFAOYSA-N
XLogP1.23
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.16
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one with MolForge

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

Launch Full Analysis

Related Compounds

3-amino-1-(furan-3-yl)-2,2,3-trimethylbutan-1-one
CID 116573777
2-(dimethylamino)-1-(furan-3-yl)-2-methylbutan-1-one
CID 79064147
2-(4-fluorophenyl)-1-(furan-3-yl)-2-methylpropan-1-one
CID 64759760
furan-3-carboxylic acid;dihydrochloride
CID 141114987
2-ethoxy-2-ethyl-1-(furan-3-yl)butan-1-one
CID 116747226
ethane;1-(furan-3-yl)ethanone;methane
CID 145092753
2-(furan-3-carbonylamino)-2-methylpropanoic acid
CID 61262985
furan-3-carbonyl(trimethyl)azanium
CID 91080420
azanium furan-3-carboxylate
CID 176901239
2-hydroxy-2-methyl-1-phenylpropan-1-one;sulfane
CID 70599278
(furan-3-carbonylamino) 2,2-dimethylpropanoate
CID 170986081
tert-butyl N-(furan-3-carbonyl)carbamate
CID 176560288

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one?
The IUPAC name of 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one (CID 15504484) is 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one.
What is the SMILES notation for 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one?
The canonical SMILES for 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one is CC(C)(O)C(=O)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one?
The InChIKey is CKPPHRMMGIJYTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O3/c1-8(2,10)7(9)6-3-4-11-5-6/h3-5,10H,1-2H3.
What are the key properties of 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one?
1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one has a molecular weight of 154.16 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-2-hydroxy-2-methylpropan-1-one is sourced from PubChem (CID 15504484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).