1-(furan-3-yl)-3-phenylbutan-1-ol

C14H16O2 — CID 63948352

IUPAC1-(furan-3-yl)-3-phenylbutan-1-ol
SMILESCC(CC(O)c1ccoc1)c1ccccc1
InChIInChI=1S/C14H16O2/c1-11(12-5-3-2-4-6-12)9-14(15)13-7-8-16-10-13/h2-8,10-11,14-15H,9H2,1H3
InChIKeyIZNSBDSSNLNVSF-UHFFFAOYSA-N
MW216.28 g/mol
LogP3.51
Rot. Bonds4

About 1-(furan-3-yl)-3-phenylbutan-1-ol

1-(furan-3-yl)-3-phenylbutan-1-ol (PubChem CID 63948352) has the molecular formula C14H16O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-(furan-3-yl)-3-phenylbutan-1-ol.

Molecular Properties

Compound Name1-(furan-3-yl)-3-phenylbutan-1-ol
PubChem CID63948352
Molecular FormulaC14H16O2
Molecular Weight216.28 g/mol
Exact Mass216.12
IUPAC Name1-(furan-3-yl)-3-phenylbutan-1-ol
SMILESCC(CC(O)c1ccoc1)c1ccccc1
InChIInChI=1S/C14H16O2/c1-11(12-5-3-2-4-6-12)9-14(15)13-7-8-16-10-13/h2-8,10-11,14-15H,9H2,1H3
InChIKeyIZNSBDSSNLNVSF-UHFFFAOYSA-N
XLogP3.51
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenylbutane-1,1-diol
CID 18417931
(1S,3S)-1-(furan-3-yl)-5-trimethylsilylpent-4-yne-1,3-diol
CID 11020968
N-[(3S)-3-(furan-3-yl)-3-hydroxypropyl]-N'-[(1S)-1-phenylethyl]oxamide
CID 97106356
(4R)-2-methyl-6-phenylheptan-4-ol
CID 135043417
(1R)-1-(furan-3-yl)propane-1,3-diol
CID 124583240
1,2-bis(furan-3-yl)ethanol
CID 83172033
1-benzhydryl-3-[2-(furan-3-yl)-2-hydroxyethyl]urea
CID 71798424
1-(1-benzofuran-2-yl)-3-phenylbutan-1-ol
CID 114723712
1-(furan-3-yl)-3-(2-methylphenyl)propan-1-ol
CID 105097163
(1R)-3-chloro-1-(furan-3-yl)propan-1-ol
CID 55298538
(1S)-1-(furan-3-yl)butane-1,4-diol
CID 129362358
1-(2,3-dimethylphenyl)-3-phenylbutan-1-ol
CID 63899543

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-3-phenylbutan-1-ol?
The IUPAC name of 1-(furan-3-yl)-3-phenylbutan-1-ol (CID 63948352) is 1-(furan-3-yl)-3-phenylbutan-1-ol.
What is the SMILES notation for 1-(furan-3-yl)-3-phenylbutan-1-ol?
The canonical SMILES for 1-(furan-3-yl)-3-phenylbutan-1-ol is CC(CC(O)c1ccoc1)c1ccccc1.
What is the InChIKey of 1-(furan-3-yl)-3-phenylbutan-1-ol?
The InChIKey is IZNSBDSSNLNVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O2/c1-11(12-5-3-2-4-6-12)9-14(15)13-7-8-16-10-13/h2-8,10-11,14-15H,9H2,1H3.
What are the key properties of 1-(furan-3-yl)-3-phenylbutan-1-ol?
1-(furan-3-yl)-3-phenylbutan-1-ol has a molecular weight of 216.28 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-3-phenylbutan-1-ol is sourced from PubChem (CID 63948352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).