1-(furan-2-yl)-5-methoxyhexan-2-ol

C11H18O3 — CID 105122918

IUPAC1-(furan-2-yl)-5-methoxyhexan-2-ol
SMILESCOC(C)CCC(O)Cc1ccco1
InChIInChI=1S/C11H18O3/c1-9(13-2)5-6-10(12)8-11-4-3-7-14-11/h3-4,7,9-10,12H,5-6,8H2,1-2H3
InChIKeyKAPNYDYVRAOZGC-UHFFFAOYSA-N
MW198.26 g/mol
LogP2.00
Rot. Bonds6

About 1-(furan-2-yl)-5-methoxyhexan-2-ol

1-(furan-2-yl)-5-methoxyhexan-2-ol (PubChem CID 105122918) has the molecular formula C11H18O3 and a molecular weight of 198.26 g/mol. Its IUPAC name is 1-(furan-2-yl)-5-methoxyhexan-2-ol.

Molecular Properties

Compound Name1-(furan-2-yl)-5-methoxyhexan-2-ol
PubChem CID105122918
Molecular FormulaC11H18O3
Molecular Weight198.26 g/mol
Exact Mass198.13
IUPAC Name1-(furan-2-yl)-5-methoxyhexan-2-ol
SMILESCOC(C)CCC(O)Cc1ccco1
InChIInChI=1S/C11H18O3/c1-9(13-2)5-6-10(12)8-11-4-3-7-14-11/h3-4,7,9-10,12H,5-6,8H2,1-2H3
InChIKeyKAPNYDYVRAOZGC-UHFFFAOYSA-N
XLogP2.00
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(furan-2-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105331576
1-(furan-2-yl)hexan-2-ol
CID 83171633
4-ethylsulfanyl-1-(furan-2-yl)butan-2-ol
CID 116504764
4-cyclohexyl-1-(furan-2-yl)butan-2-ol
CID 115830128
1-(furan-2-yl)-3-(4-methoxyphenoxy)propan-2-ol
CID 117246167
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
1-(furan-2-yl)-6-methylheptan-3-ol
CID 105085501
1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol
CID 105122992
methyl (2S)-3-(furan-2-yl)-2-hydroxypropanoate
CID 15638338
1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol
CID 117246144
1-(3-fluorophenyl)-5-methoxyhexan-2-ol
CID 105078984
1-(furan-2-yl)propan-2-yl carbamate
CID 67843163

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-5-methoxyhexan-2-ol?
The IUPAC name of 1-(furan-2-yl)-5-methoxyhexan-2-ol (CID 105122918) is 1-(furan-2-yl)-5-methoxyhexan-2-ol.
What is the SMILES notation for 1-(furan-2-yl)-5-methoxyhexan-2-ol?
The canonical SMILES for 1-(furan-2-yl)-5-methoxyhexan-2-ol is COC(C)CCC(O)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-5-methoxyhexan-2-ol?
The InChIKey is KAPNYDYVRAOZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O3/c1-9(13-2)5-6-10(12)8-11-4-3-7-14-11/h3-4,7,9-10,12H,5-6,8H2,1-2H3.
What are the key properties of 1-(furan-2-yl)-5-methoxyhexan-2-ol?
1-(furan-2-yl)-5-methoxyhexan-2-ol has a molecular weight of 198.26 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-5-methoxyhexan-2-ol is sourced from PubChem (CID 105122918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).