6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran

C17H16O2 — CID 117185801

IUPAC6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran
SMILESCc1ccc2cc(COc3ccccc3C)oc2c1
InChIInChI=1S/C17H16O2/c1-12-7-8-14-10-15(19-17(14)9-12)11-18-16-6-4-3-5-13(16)2/h3-10H,11H2,1-2H3
InChIKeyMHNGFJULOKUEPI-UHFFFAOYSA-N
MW252.31 g/mol
LogP4.63
Rot. Bonds3

About 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran

6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran (PubChem CID 117185801) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran.

Molecular Properties

Compound Name6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran
PubChem CID117185801
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran
SMILESCc1ccc2cc(COc3ccccc3C)oc2c1
InChIInChI=1S/C17H16O2/c1-12-7-8-14-10-15(19-17(14)9-12)11-18-16-6-4-3-5-13(16)2/h3-10H,11H2,1-2H3
InChIKeyMHNGFJULOKUEPI-UHFFFAOYSA-N
XLogP4.63
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran
CID 117184698
2-[(4-methoxyphenoxy)methyl]-6-methyl-1-benzofuran
CID 117185820
1,4-dimethyl-2-[(2-methylphenoxy)methyl]benzene
CID 60627928
7-bromo-2-[(2-methylphenoxy)methyl]-1-benzofuran
CID 117182771
6-chloro-2-[(2-methoxyphenoxy)methyl]-1-benzofuran
CID 117179334
N-methyl-1-[3-methyl-5-[(2-methylphenoxy)methyl]furan-2-yl]methanamine
CID 62452733
[2-[(2-chlorophenoxy)methyl]-1-benzofuran-6-yl]methanamine
CID 117179218
N-methyl-1-[2-methyl-5-[(2-methylphenoxy)methyl]furan-3-yl]methanamine
CID 62453604
2-[(3-methoxyphenoxy)methyl]-5-methyl-1-benzofuran
CID 117185258
2-[(2-fluorophenoxy)methyl]-1-benzofuran-6-carboxylic acid
CID 117179456
4-methyl-2-[[2-(trifluoromethyl)phenoxy]methyl]-1-benzofuran
CID 117184696
3-(6-methyl-1-benzofuran-2-yl)propan-1-amine
CID 82504582

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran?
The IUPAC name of 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran (CID 117185801) is 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran.
What is the SMILES notation for 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran?
The canonical SMILES for 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran is Cc1ccc2cc(COc3ccccc3C)oc2c1.
What is the InChIKey of 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran?
The InChIKey is MHNGFJULOKUEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O2/c1-12-7-8-14-10-15(19-17(14)9-12)11-18-16-6-4-3-5-13(16)2/h3-10H,11H2,1-2H3.
What are the key properties of 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran?
6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran has a molecular weight of 252.31 g/mol, XLogP of 4.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(2-methylphenoxy)methyl]-1-benzofuran is sourced from PubChem (CID 117185801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).