(4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol

C14H16O3 — CID 61082456

IUPAC(4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccoc2C)cc1C
InChIInChI=1S/C14H16O3/c1-9-8-11(4-5-13(9)16-3)14(15)12-6-7-17-10(12)2/h4-8,14-15H,1-3H3
InChIKeyQEUQJCUAASGCTJ-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.99
Rot. Bonds3

About (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol

(4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol (PubChem CID 61082456) has the molecular formula C14H16O3 and a molecular weight of 232.28 g/mol. Its IUPAC name is (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol.

Molecular Properties

Compound Name(4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol
PubChem CID61082456
Molecular FormulaC14H16O3
Molecular Weight232.28 g/mol
Exact Mass232.11
IUPAC Name(4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccoc2C)cc1C
InChIInChI=1S/C14H16O3/c1-9-8-11(4-5-13(9)16-3)14(15)12-6-7-17-10(12)2/h4-8,14-15H,1-3H3
InChIKeyQEUQJCUAASGCTJ-UHFFFAOYSA-N
XLogP2.99
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-4-methoxyphenyl)-(2-methylfuran-3-yl)methanol
CID 61100656
3-[chloro-(4-methoxy-3-methylphenyl)methyl]-2-methylfuran
CID 61084840
(2-bromo-4,5-dimethoxyphenyl)-(2-methylfuran-3-yl)methanol
CID 61088712
(2,4-dimethoxyphenyl)-(2-methylfuran-3-yl)methanol
CID 61086779
(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61081454
(1S)-1-(4-methoxy-3-methylphenyl)ethanol
CID 39236071
(3-bromo-4-methoxyphenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61080516
(4-tert-butylphenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61080698
(5-bromo-2-chlorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61082254
isoquinolin-4-yl-(4-methoxy-3-methylphenyl)methanol
CID 63940924
(2-chloro-4,5-dimethylphenyl)-(2-methylfuran-3-yl)methanol
CID 115484595
(4-fluoro-3-methylphenyl)-(2-methoxyphenyl)methanol
CID 60929843

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol?
The IUPAC name of (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol (CID 61082456) is (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol.
What is the SMILES notation for (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol?
The canonical SMILES for (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol is COc1ccc(C(O)c2ccoc2C)cc1C.
What is the InChIKey of (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol?
The InChIKey is QEUQJCUAASGCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O3/c1-9-8-11(4-5-13(9)16-3)14(15)12-6-7-17-10(12)2/h4-8,14-15H,1-3H3.
What are the key properties of (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol?
(4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol has a molecular weight of 232.28 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3-methylphenyl)-(2-methylfuran-3-yl)methanol is sourced from PubChem (CID 61082456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).