2-butyl-5-(4-methylphenyl)furan

C15H18O — CID 86258788

IUPAC2-butyl-5-(4-methylphenyl)furan
SMILESCCCCc1ccc(-c2ccc(C)cc2)o1
InChIInChI=1S/C15H18O/c1-3-4-5-14-10-11-15(16-14)13-8-6-12(2)7-9-13/h6-11H,3-5H2,1-2H3
InChIKeyBYQZKPXFDYZWFT-UHFFFAOYSA-N
MW214.31 g/mol
LogP4.60
Rot. Bonds4

About 2-butyl-5-(4-methylphenyl)furan

2-butyl-5-(4-methylphenyl)furan (PubChem CID 86258788) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-butyl-5-(4-methylphenyl)furan.

Molecular Properties

Compound Name2-butyl-5-(4-methylphenyl)furan
PubChem CID86258788
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Name2-butyl-5-(4-methylphenyl)furan
SMILESCCCCc1ccc(-c2ccc(C)cc2)o1
InChIInChI=1S/C15H18O/c1-3-4-5-14-10-11-15(16-14)13-8-6-12(2)7-9-13/h6-11H,3-5H2,1-2H3
InChIKeyBYQZKPXFDYZWFT-UHFFFAOYSA-N
XLogP4.60
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chlorophenyl)-5-propylfuran
CID 91550346
4-(5-hexylfuran-2-yl)benzene-1,2-diol
CID 24871715
N-[[5-(4-butylphenyl)furan-2-yl]methyl]propan-2-amine
CID 43624940
2-bromo-5-butylfuran
CID 59059059
3-[5-(4-chlorophenyl)furan-2-yl]propan-1-ol
CID 170887546
3-[5-(4-bromophenyl)furan-2-yl]propan-1-amine
CID 170878277
2-butyl-5-(2,3,5,6-tetrafluoro-4-naphthalen-2-ylphenyl)furan
CID 71663561
N-[[5-(4-bromophenyl)furan-2-yl]methyl]butan-1-amine
CID 4723752
N-[[5-(4-bromophenyl)furan-2-yl]methyl]pentan-1-amine
CID 4723764
N,N-bis[[5-(4-chlorophenyl)furan-2-yl]methyl]pentan-1-amine
CID 21413431
N-butylformamide;2-methyl-5-(4-methylphenyl)furan
CID 144855927
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]heptan-1-amine
CID 4723512

Frequently Asked Questions

What is the IUPAC name of 2-butyl-5-(4-methylphenyl)furan?
The IUPAC name of 2-butyl-5-(4-methylphenyl)furan (CID 86258788) is 2-butyl-5-(4-methylphenyl)furan.
What is the SMILES notation for 2-butyl-5-(4-methylphenyl)furan?
The canonical SMILES for 2-butyl-5-(4-methylphenyl)furan is CCCCc1ccc(-c2ccc(C)cc2)o1.
What is the InChIKey of 2-butyl-5-(4-methylphenyl)furan?
The InChIKey is BYQZKPXFDYZWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c1-3-4-5-14-10-11-15(16-14)13-8-6-12(2)7-9-13/h6-11H,3-5H2,1-2H3.
What are the key properties of 2-butyl-5-(4-methylphenyl)furan?
2-butyl-5-(4-methylphenyl)furan has a molecular weight of 214.31 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-5-(4-methylphenyl)furan is sourced from PubChem (CID 86258788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).