[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol

C13H14O3 — CID 68515517

IUPAC[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol
SMILESCOc1ccccc1-c1cc(CO)c(C)o1
InChIInChI=1S/C13H14O3/c1-9-10(8-14)7-13(16-9)11-5-3-4-6-12(11)15-2/h3-7,14H,8H2,1-2H3
InChIKeyLDSIPJBYUGNXDO-UHFFFAOYSA-N
MW218.25 g/mol
LogP2.76
Rot. Bonds3

About [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol

[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol (PubChem CID 68515517) has the molecular formula C13H14O3 and a molecular weight of 218.25 g/mol. Its IUPAC name is [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol.

Molecular Properties

Compound Name[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol
PubChem CID68515517
Molecular FormulaC13H14O3
Molecular Weight218.25 g/mol
Exact Mass218.09
IUPAC Name[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol
SMILESCOc1ccccc1-c1cc(CO)c(C)o1
InChIInChI=1S/C13H14O3/c1-9-10(8-14)7-13(16-9)11-5-3-4-6-12(11)15-2/h3-7,14H,8H2,1-2H3
InChIKeyLDSIPJBYUGNXDO-UHFFFAOYSA-N
XLogP2.76
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(2-methoxyphenyl)-2-methylfuran-3-yl]ethanone
CID 10443838
[3-(2-methoxyphenyl)-5-methyl-1,2-oxazol-4-yl]methanol
CID 10932935
(2-(111C)methoxyphenyl)methanol
CID 59897789
[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol
CID 23074335
[4-(2-methoxyphenyl)-5-methyl-1,2-oxazol-3-yl]methanol
CID 174708303
[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanol
CID 105473690
[2-amino-5-(2-methoxyphenyl)-3-pyridinyl]methanol
CID 115037715
2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one
CID 13190885
5-hydroxy-2-(2-methoxyphenyl)chromen-4-one
CID 688677
2-(2-methoxyphenyl)-6-methyl-1-benzofuran-4-carboxylic acid
CID 175186064
[2-[6-(hydroxymethyl)-2,3,4-trimethoxyphenyl]phenyl]methanol
CID 44578876
2,4-dimethoxy-7-(2-methoxyphenyl)pyrano[4,3-d]pyrimidin-5-one
CID 14319823

Frequently Asked Questions

What is the IUPAC name of [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol?
The IUPAC name of [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol (CID 68515517) is [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol.
What is the SMILES notation for [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol?
The canonical SMILES for [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol is COc1ccccc1-c1cc(CO)c(C)o1.
What is the InChIKey of [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol?
The InChIKey is LDSIPJBYUGNXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O3/c1-9-10(8-14)7-13(16-9)11-5-3-4-6-12(11)15-2/h3-7,14H,8H2,1-2H3.
What are the key properties of [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol?
[5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol has a molecular weight of 218.25 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methoxyphenyl)-2-methylfuran-3-yl]methanol is sourced from PubChem (CID 68515517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).