1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol

C15H16O3 — CID 114743643

IUPAC1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol
SMILESCC(O)(c1ccoc1)c1cccc2c1OCCC2
InChIInChI=1S/C15H16O3/c1-15(16,12-7-9-17-10-12)13-6-2-4-11-5-3-8-18-14(11)13/h2,4,6-7,9-10,16H,3,5,8H2,1H3
InChIKeyRYPPUJXEKKWLSX-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.86
Rot. Bonds2

About 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol

1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol (PubChem CID 114743643) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol
PubChem CID114743643
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol
SMILESCC(O)(c1ccoc1)c1cccc2c1OCCC2
InChIInChI=1S/C15H16O3/c1-15(16,12-7-9-17-10-12)13-6-2-4-11-5-3-8-18-14(11)13/h2,4,6-7,9-10,16H,3,5,8H2,1H3
InChIKeyRYPPUJXEKKWLSX-UHFFFAOYSA-N
XLogP2.86
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(3,4-dihydro-2H-chromen-8-yl)-1-hydroxyethyl]benzonitrile
CID 114743649
1-(3,4-dihydro-2H-chromen-8-yl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 114743705
1-(3,4-dihydro-2H-chromen-8-yl)-1-(2-methylphenyl)ethanamine
CID 114743820
1-amino-2-(3,4-dihydro-2H-chromen-8-yl)butan-2-ol
CID 114743669
3-(3,4-dihydro-2H-chromen-8-yl)-3-methylbutan-1-amine
CID 114747537
1-(3,4-dihydro-2H-chromen-8-yl)-1-piperidin-3-ylethanol
CID 114743230
2-(3,4-dihydro-2H-chromen-8-yl)-2-fluoro-3,3-dimethylbutan-1-amine
CID 114747718
2-[2-(3,4-dihydro-2H-chromen-8-yl)propan-2-yl]-5-methylcyclohexan-1-ol
CID 114747022
1-(2,5-dimethylphenyl)-1-(furan-3-yl)ethanol
CID 63950172
2-amino-2-(3,4-dihydro-2H-chromen-8-yl)-3,3,3-trifluoropropanoic acid
CID 114746833
2-(2,3-dihydro-1-benzofuran-7-yl)-4-methylpentan-2-ol
CID 114743757
1-(3,4-dihydro-2H-chromen-8-yl)ethanone
CID 82599043

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol?
The IUPAC name of 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol (CID 114743643) is 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol.
What is the SMILES notation for 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol?
The canonical SMILES for 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol is CC(O)(c1ccoc1)c1cccc2c1OCCC2.
What is the InChIKey of 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol?
The InChIKey is RYPPUJXEKKWLSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-15(16,12-7-9-17-10-12)13-6-2-4-11-5-3-8-18-14(11)13/h2,4,6-7,9-10,16H,3,5,8H2,1H3.
What are the key properties of 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol?
1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol has a molecular weight of 244.29 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-chromen-8-yl)-1-(furan-3-yl)ethanol is sourced from PubChem (CID 114743643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).