1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol

C14H18O2 — CID 65439756

IUPAC1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol
SMILESCCCC(O)c1cc2cc(CC)ccc2o1
InChIInChI=1S/C14H18O2/c1-3-5-12(15)14-9-11-8-10(4-2)6-7-13(11)16-14/h6-9,12,15H,3-5H2,1-2H3
InChIKeyQHFIHMJVFMCFKC-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.83
Rot. Bonds4

About 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol

1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol (PubChem CID 65439756) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol.

Molecular Properties

Compound Name1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol
PubChem CID65439756
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol
SMILESCCCC(O)c1cc2cc(CC)ccc2o1
InChIInChI=1S/C14H18O2/c1-3-5-12(15)14-9-11-8-10(4-2)6-7-13(11)16-14/h6-9,12,15H,3-5H2,1-2H3
InChIKeyQHFIHMJVFMCFKC-UHFFFAOYSA-N
XLogP3.83
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-ethyl-1-benzofuran-2-yl)-N-methylpropan-1-amine
CID 65441154
N-ethyl-1-(5-ethyl-1-benzofuran-2-yl)propan-1-amine
CID 65440784
(5-ethyl-1-benzofuran-2-yl)methanol
CID 65439757
1-(5-chloro-1-benzofuran-2-yl)-3-(4-methylphenyl)propan-1-ol
CID 105129392
1-(1-benzofuran-2-yl)heptan-1-ol
CID 63089894
(4-ethylphenyl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 114723460
(4-chlorophenyl)-(5-ethyl-1-benzofuran-2-yl)methanamine
CID 43826510
(1S)-1-(5-chloro-1-benzofuran-2-yl)propan-1-ol
CID 96826863
1-(5-propyl-1-benzofuran-2-yl)ethanamine
CID 65439611
3-ethylsulfanyl-1-(5-methyl-1-benzofuran-2-yl)propan-1-ol
CID 114724900
3-(diethylamino)-1-(5-methyl-1-benzofuran-2-yl)propan-1-ol
CID 114726904
2-(3,5-dimethylphenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 114726442

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol?
The IUPAC name of 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol (CID 65439756) is 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol.
What is the SMILES notation for 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol?
The canonical SMILES for 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol is CCCC(O)c1cc2cc(CC)ccc2o1.
What is the InChIKey of 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol?
The InChIKey is QHFIHMJVFMCFKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-3-5-12(15)14-9-11-8-10(4-2)6-7-13(11)16-14/h6-9,12,15H,3-5H2,1-2H3.
What are the key properties of 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol?
1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol has a molecular weight of 218.30 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1-benzofuran-2-yl)butan-1-ol is sourced from PubChem (CID 65439756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).