2-methyl-5-(1-phenylethyl)furan

C13H14O — CID 101473282

IUPAC2-methyl-5-(1-phenylethyl)furan
SMILESCc1ccc(C(C)c2ccccc2)o1
InChIInChI=1S/C13H14O/c1-10-8-9-13(14-10)11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3
InChIKeyDSKQWKUEHINYHK-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.74
Rot. Bonds2

About 2-methyl-5-(1-phenylethyl)furan

2-methyl-5-(1-phenylethyl)furan (PubChem CID 101473282) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-methyl-5-(1-phenylethyl)furan.

Molecular Properties

Compound Name2-methyl-5-(1-phenylethyl)furan
PubChem CID101473282
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name2-methyl-5-(1-phenylethyl)furan
SMILESCc1ccc(C(C)c2ccccc2)o1
InChIInChI=1S/C13H14O/c1-10-8-9-13(14-10)11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3
InChIKeyDSKQWKUEHINYHK-UHFFFAOYSA-N
XLogP3.74
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-(5-methylfuran-2-yl)-1-phenylmethanamine
CID 43481483
1-phenylethylbenzene
CID 142851428
1-phenylethylbenzene
CID 11918
2-[chloro-(4-phenylphenyl)methyl]-5-methylfuran
CID 63429545
1-phenylethylbenzene;stibane
CID 174965918
ethane;1-phenylethylbenzene
CID 164998811
2-methyl-5-[(2S)-3-methylbutan-2-yl]furan
CID 59302907
N,N-dimethyl-N'-[1-(5-methylfuran-2-yl)ethyl]-1-phenylethane-1,2-diamine
CID 43201795
N-[1-(5-methylfuran-2-yl)ethyl]-1-phenylbutan-1-amine
CID 43684931
2-hydroxy-N-[1-(5-methylfuran-2-yl)ethyl]-2-phenylacetamide
CID 110884058
ethane;methane;1-phenylethylbenzene
CID 143105414
2-[[4-[bis(5-methylfuran-2-yl)methyl]phenyl]-(5-methylfuran-2-yl)methyl]-5-methylfuran
CID 2751428

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(1-phenylethyl)furan?
The IUPAC name of 2-methyl-5-(1-phenylethyl)furan (CID 101473282) is 2-methyl-5-(1-phenylethyl)furan.
What is the SMILES notation for 2-methyl-5-(1-phenylethyl)furan?
The canonical SMILES for 2-methyl-5-(1-phenylethyl)furan is Cc1ccc(C(C)c2ccccc2)o1.
What is the InChIKey of 2-methyl-5-(1-phenylethyl)furan?
The InChIKey is DSKQWKUEHINYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-10-8-9-13(14-10)11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3.
What are the key properties of 2-methyl-5-(1-phenylethyl)furan?
2-methyl-5-(1-phenylethyl)furan has a molecular weight of 186.25 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(1-phenylethyl)furan is sourced from PubChem (CID 101473282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).