2,3-dimethyl-5-(2-methylphenyl)furan

C13H14O — CID 172731165

IUPAC2,3-dimethyl-5-(2-methylphenyl)furan
SMILESCc1ccccc1-c1cc(C)c(C)o1
InChIInChI=1S/C13H14O/c1-9-6-4-5-7-12(9)13-8-10(2)11(3)14-13/h4-8H,1-3H3
InChIKeyHUSCBZCZZARZCX-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.87
Rot. Bonds1

About 2,3-dimethyl-5-(2-methylphenyl)furan

2,3-dimethyl-5-(2-methylphenyl)furan (PubChem CID 172731165) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 2,3-dimethyl-5-(2-methylphenyl)furan.

Molecular Properties

Compound Name2,3-dimethyl-5-(2-methylphenyl)furan
PubChem CID172731165
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name2,3-dimethyl-5-(2-methylphenyl)furan
SMILESCc1ccccc1-c1cc(C)c(C)o1
InChIInChI=1S/C13H14O/c1-9-6-4-5-7-12(9)13-8-10(2)11(3)14-13/h4-8H,1-3H3
InChIKeyHUSCBZCZZARZCX-UHFFFAOYSA-N
XLogP3.87
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methylphenyl)chromen-4-one
CID 776385
7-methyl-2-(2-methylphenyl)chromen-4-one
CID 4038144
ethane;2-(2-methylphenyl)furan
CID 142082580
ethene;1-methyl-2-(2-methylphenyl)benzene
CID 145078997
5-(2-methylphenyl)-1,2-oxazol-3-one
CID 19596684
ethane;1,3,5-tris(2-methylphenyl)benzene
CID 157145659
1,3-bis(2-methylphenyl)-2-benzofuran
CID 59096365
dimethylsilane;1-methyl-2-(2-methylphenyl)benzene
CID 162166796
5-(3-methoxyphenyl)-2,3-dimethylfuran
CID 70996763
3-(2-methylphenyl)-7-nitrosoisochromen-1-one
CID 138613154
4-(4,5-dimethylfuran-2-yl)-3-methyl-1-phenylpyrazolo[5,4-b]pyridine-6-carboxylic acid
CID 134085809
[5-(2-methylphenyl)-1,2-oxazol-3-yl]methanethiol
CID 165479825

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-(2-methylphenyl)furan?
The IUPAC name of 2,3-dimethyl-5-(2-methylphenyl)furan (CID 172731165) is 2,3-dimethyl-5-(2-methylphenyl)furan.
What is the SMILES notation for 2,3-dimethyl-5-(2-methylphenyl)furan?
The canonical SMILES for 2,3-dimethyl-5-(2-methylphenyl)furan is Cc1ccccc1-c1cc(C)c(C)o1.
What is the InChIKey of 2,3-dimethyl-5-(2-methylphenyl)furan?
The InChIKey is HUSCBZCZZARZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-9-6-4-5-7-12(9)13-8-10(2)11(3)14-13/h4-8H,1-3H3.
What are the key properties of 2,3-dimethyl-5-(2-methylphenyl)furan?
2,3-dimethyl-5-(2-methylphenyl)furan has a molecular weight of 186.25 g/mol, XLogP of 3.87, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-(2-methylphenyl)furan is sourced from PubChem (CID 172731165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).