(4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol

C15H18O3 — CID 65153068

IUPAC(4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
SMILESCOc1ccc(C(O)c2c(C)oc(C)c2C)cc1
InChIInChI=1S/C15H18O3/c1-9-10(2)18-11(3)14(9)15(16)12-5-7-13(17-4)8-6-12/h5-8,15-16H,1-4H3
InChIKeyMBDVVIGKZDMEMO-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.30
Rot. Bonds3

About (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol

(4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol (PubChem CID 65153068) has the molecular formula C15H18O3 and a molecular weight of 246.31 g/mol. Its IUPAC name is (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol.

Molecular Properties

Compound Name(4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
PubChem CID65153068
Molecular FormulaC15H18O3
Molecular Weight246.31 g/mol
Exact Mass246.13
IUPAC Name(4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
SMILESCOc1ccc(C(O)c2c(C)oc(C)c2C)cc1
InChIInChI=1S/C15H18O3/c1-9-10(2)18-11(3)14(9)15(16)12-5-7-13(17-4)8-6-12/h5-8,15-16H,1-4H3
InChIKeyMBDVVIGKZDMEMO-UHFFFAOYSA-N
XLogP3.30
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-ethoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 65153070
(4-methoxyphenyl)-(2-methyl-1-benzofuran-3-yl)methanol
CID 15307875
[5-[hydroxy-(4-methoxyphenyl)methyl]furan-2-yl]-(4-methoxyphenyl)methanol
CID 141159898
(5-bromofuran-2-yl)-(4-methoxyphenyl)methanol
CID 61099698
(4-iodophenyl)-(4-methoxyphenyl)methanol
CID 61098998
(3-ethoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 115827546
bis[4-(4-methoxy-N-methylanilino)phenyl]methanol
CID 139653192
(6-methoxynaphthalen-2-yl)-(5-methylfuran-3-yl)methanol
CID 114822321
(4-fluoro-3,5-dimethylphenyl)-(4-methoxyphenyl)methanol
CID 65296830
[4-(4-methoxyphenyl)phenyl]-phenylmethanol
CID 141264274
(4-methoxyphenyl)-(6-methyl-3-pyridinyl)methanol
CID 63155903
(S)-(4-methoxyphenyl)-(5-methylthiophen-2-yl)methanol
CID 40535084

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
The IUPAC name of (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol (CID 65153068) is (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol.
What is the SMILES notation for (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
The canonical SMILES for (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol is COc1ccc(C(O)c2c(C)oc(C)c2C)cc1.
What is the InChIKey of (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
The InChIKey is MBDVVIGKZDMEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3/c1-9-10(2)18-11(3)14(9)15(16)12-5-7-13(17-4)8-6-12/h5-8,15-16H,1-4H3.
What are the key properties of (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
(4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol has a molecular weight of 246.31 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol is sourced from PubChem (CID 65153068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).