furan-2-yl-(1-phenylcyclobutyl)methanone

C15H14O2 — CID 63947949

IUPACfuran-2-yl-(1-phenylcyclobutyl)methanone
SMILESO=C(c1ccco1)C1(c2ccccc2)CCC1
InChIInChI=1S/C15H14O2/c16-14(13-8-4-11-17-13)15(9-5-10-15)12-6-2-1-3-7-12/h1-4,6-8,11H,5,9-10H2
InChIKeyQJKYNGVOHDOHLK-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.58
Rot. Bonds3

About furan-2-yl-(1-phenylcyclobutyl)methanone

furan-2-yl-(1-phenylcyclobutyl)methanone (PubChem CID 63947949) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is furan-2-yl-(1-phenylcyclobutyl)methanone.

Molecular Properties

Compound Namefuran-2-yl-(1-phenylcyclobutyl)methanone
PubChem CID63947949
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Namefuran-2-yl-(1-phenylcyclobutyl)methanone
SMILESO=C(c1ccco1)C1(c2ccccc2)CCC1
InChIInChI=1S/C15H14O2/c16-14(13-8-4-11-17-13)15(9-5-10-15)12-6-2-1-3-7-12/h1-4,6-8,11H,5,9-10H2
InChIKeyQJKYNGVOHDOHLK-UHFFFAOYSA-N
XLogP3.58
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(1-phenylcyclobutyl)methanone?
The IUPAC name of furan-2-yl-(1-phenylcyclobutyl)methanone (CID 63947949) is furan-2-yl-(1-phenylcyclobutyl)methanone.
What is the SMILES notation for furan-2-yl-(1-phenylcyclobutyl)methanone?
The canonical SMILES for furan-2-yl-(1-phenylcyclobutyl)methanone is O=C(c1ccco1)C1(c2ccccc2)CCC1.
What is the InChIKey of furan-2-yl-(1-phenylcyclobutyl)methanone?
The InChIKey is QJKYNGVOHDOHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c16-14(13-8-4-11-17-13)15(9-5-10-15)12-6-2-1-3-7-12/h1-4,6-8,11H,5,9-10H2.
What are the key properties of furan-2-yl-(1-phenylcyclobutyl)methanone?
furan-2-yl-(1-phenylcyclobutyl)methanone has a molecular weight of 226.28 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(1-phenylcyclobutyl)methanone is sourced from PubChem (CID 63947949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).