cyclopentyl-(4-phenylphenyl)methanone

C18H18O — CID 43337740

IUPACcyclopentyl-(4-phenylphenyl)methanone
SMILESO=C(c1ccc(-c2ccccc2)cc1)C1CCCC1
InChIInChI=1S/C18H18O/c19-18(16-8-4-5-9-16)17-12-10-15(11-13-17)14-6-2-1-3-7-14/h1-3,6-7,10-13,16H,4-5,8-9H2
InChIKeyVUBPPMBKGNEPRL-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.73
Rot. Bonds3

About cyclopentyl-(4-phenylphenyl)methanone

cyclopentyl-(4-phenylphenyl)methanone (PubChem CID 43337740) has the molecular formula C18H18O and a molecular weight of 250.34 g/mol. Its IUPAC name is cyclopentyl-(4-phenylphenyl)methanone.

Molecular Properties

Compound Namecyclopentyl-(4-phenylphenyl)methanone
PubChem CID43337740
Molecular FormulaC18H18O
Molecular Weight250.34 g/mol
Exact Mass250.14
IUPAC Namecyclopentyl-(4-phenylphenyl)methanone
SMILESO=C(c1ccc(-c2ccccc2)cc1)C1CCCC1
InChIInChI=1S/C18H18O/c19-18(16-8-4-5-9-16)17-12-10-15(11-13-17)14-6-2-1-3-7-14/h1-3,6-7,10-13,16H,4-5,8-9H2
InChIKeyVUBPPMBKGNEPRL-UHFFFAOYSA-N
XLogP4.73
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(4-phenylphenyl)methanone?
The IUPAC name of cyclopentyl-(4-phenylphenyl)methanone (CID 43337740) is cyclopentyl-(4-phenylphenyl)methanone.
What is the SMILES notation for cyclopentyl-(4-phenylphenyl)methanone?
The canonical SMILES for cyclopentyl-(4-phenylphenyl)methanone is O=C(c1ccc(-c2ccccc2)cc1)C1CCCC1.
What is the InChIKey of cyclopentyl-(4-phenylphenyl)methanone?
The InChIKey is VUBPPMBKGNEPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O/c19-18(16-8-4-5-9-16)17-12-10-15(11-13-17)14-6-2-1-3-7-14/h1-3,6-7,10-13,16H,4-5,8-9H2.
What are the key properties of cyclopentyl-(4-phenylphenyl)methanone?
cyclopentyl-(4-phenylphenyl)methanone has a molecular weight of 250.34 g/mol, XLogP of 4.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(4-phenylphenyl)methanone is sourced from PubChem (CID 43337740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).