2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone

C12H16O3 — CID 103457678

IUPAC2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone
SMILESO=C(c1ccoc1)C(O)C1CCCCC1
InChIInChI=1S/C12H16O3/c13-11(9-4-2-1-3-5-9)12(14)10-6-7-15-8-10/h6-9,11,13H,1-5H2
InChIKeyOWHDRULAEZTKLT-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.40
Rot. Bonds3

About 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone

2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone (PubChem CID 103457678) has the molecular formula C12H16O3 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone
PubChem CID103457678
Molecular FormulaC12H16O3
Molecular Weight208.26 g/mol
Exact Mass208.11
IUPAC Name2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone
SMILESO=C(c1ccoc1)C(O)C1CCCCC1
InChIInChI=1S/C12H16O3/c13-11(9-4-2-1-3-5-9)12(14)10-6-7-15-8-10/h6-9,11,13H,1-5H2
InChIKeyOWHDRULAEZTKLT-UHFFFAOYSA-N
XLogP2.40
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-1-(furan-3-yl)propan-1-one
CID 114971750
N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
CID 111426324
2-cyclohexyl-2-hydroxy-1-(4-propan-2-ylphenyl)ethanone
CID 103457516
2-cycloheptyl-1-(furan-3-yl)ethanone
CID 114971700
1-cyclohexyl-2-(furan-3-yl)ethane-1,2-diol
CID 103459035
N-[(2R)-1-(cyclooctylamino)-1-oxopropan-2-yl]furan-3-carboxamide
CID 94170401
(2R)-1,2-bis(furan-3-yl)-2-hydroxyethanone
CID 11194846
3-cyclohexyl-1-(furan-3-yl)propan-1-one
CID 114971693
6-bicyclo[3.1.0]hexanyl(furan-3-yl)methanone
CID 114971785
N-cyclopropylfuran-3-carboxamide
CID 60698418
[7-[cyclohexyl(hydroxy)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(furan-3-yl)methanone
CID 56857579
N-(2-cyclopropyl-2-hydroxyethyl)furan-3-carboxamide
CID 63294562

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone?
The IUPAC name of 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone (CID 103457678) is 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone.
What is the SMILES notation for 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone?
The canonical SMILES for 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone is O=C(c1ccoc1)C(O)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone?
The InChIKey is OWHDRULAEZTKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O3/c13-11(9-4-2-1-3-5-9)12(14)10-6-7-15-8-10/h6-9,11,13H,1-5H2.
What are the key properties of 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone?
2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone has a molecular weight of 208.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone is sourced from PubChem (CID 103457678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).