2-(furan-3-ylmethyl)-2-phenylbutan-1-ol

C15H18O2 — CID 83183122

IUPAC2-(furan-3-ylmethyl)-2-phenylbutan-1-ol
SMILESCCC(CO)(Cc1ccoc1)c1ccccc1
InChIInChI=1S/C15H18O2/c1-2-15(12-16,10-13-8-9-17-11-13)14-6-4-3-5-7-14/h3-9,11,16H,2,10,12H2,1H3
InChIKeyPZWXFGWUAWLTMD-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.16
Rot. Bonds5

About 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol

2-(furan-3-ylmethyl)-2-phenylbutan-1-ol (PubChem CID 83183122) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol.

Molecular Properties

Compound Name2-(furan-3-ylmethyl)-2-phenylbutan-1-ol
PubChem CID83183122
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name2-(furan-3-ylmethyl)-2-phenylbutan-1-ol
SMILESCCC(CO)(Cc1ccoc1)c1ccccc1
InChIInChI=1S/C15H18O2/c1-2-15(12-16,10-13-8-9-17-11-13)14-6-4-3-5-7-14/h3-9,11,16H,2,10,12H2,1H3
InChIKeyPZWXFGWUAWLTMD-UHFFFAOYSA-N
XLogP3.16
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol?
The IUPAC name of 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol (CID 83183122) is 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol.
What is the SMILES notation for 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol?
The canonical SMILES for 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol is CCC(CO)(Cc1ccoc1)c1ccccc1.
What is the InChIKey of 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol?
The InChIKey is PZWXFGWUAWLTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c1-2-15(12-16,10-13-8-9-17-11-13)14-6-4-3-5-7-14/h3-9,11,16H,2,10,12H2,1H3.
What are the key properties of 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol?
2-(furan-3-ylmethyl)-2-phenylbutan-1-ol has a molecular weight of 230.31 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-ylmethyl)-2-phenylbutan-1-ol is sourced from PubChem (CID 83183122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).