[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol

C13H14O2 — CID 23074335

IUPAC[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol
SMILESCc1ccc(-c2cc(CO)c(C)o2)cc1
InChIInChI=1S/C13H14O2/c1-9-3-5-11(6-4-9)13-7-12(8-14)10(2)15-13/h3-7,14H,8H2,1-2H3
InChIKeyFORVPFBFYVNNPF-UHFFFAOYSA-N
MW202.25 g/mol
LogP3.06
Rot. Bonds2

About [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol

[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol (PubChem CID 23074335) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol.

Molecular Properties

Compound Name[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol
PubChem CID23074335
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol
SMILESCc1ccc(-c2cc(CO)c(C)o2)cc1
InChIInChI=1S/C13H14O2/c1-9-3-5-11(6-4-9)13-7-12(8-14)10(2)15-13/h3-7,14H,8H2,1-2H3
InChIKeyFORVPFBFYVNNPF-UHFFFAOYSA-N
XLogP3.06
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol?
The IUPAC name of [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol (CID 23074335) is [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol.
What is the SMILES notation for [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol?
The canonical SMILES for [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol is Cc1ccc(-c2cc(CO)c(C)o2)cc1.
What is the InChIKey of [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol?
The InChIKey is FORVPFBFYVNNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O2/c1-9-3-5-11(6-4-9)13-7-12(8-14)10(2)15-13/h3-7,14H,8H2,1-2H3.
What are the key properties of [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol?
[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol has a molecular weight of 202.25 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-5-(4-methylphenyl)furan-3-yl]methanol is sourced from PubChem (CID 23074335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).