cyclobuten-1-yl(naphthalen-2-yl)methanone

C15H12O — CID 102414446

IUPACcyclobuten-1-yl(naphthalen-2-yl)methanone
SMILESO=C(C1=CCC1)c1ccc2ccccc2c1
InChIInChI=1S/C15H12O/c16-15(12-6-3-7-12)14-9-8-11-4-1-2-5-13(11)10-14/h1-2,4-6,8-10H,3,7H2
InChIKeyJBUANDQPYDOMLU-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.74
Rot. Bonds2

About cyclobuten-1-yl(naphthalen-2-yl)methanone

cyclobuten-1-yl(naphthalen-2-yl)methanone (PubChem CID 102414446) has the molecular formula C15H12O and a molecular weight of 208.26 g/mol. Its IUPAC name is cyclobuten-1-yl(naphthalen-2-yl)methanone.

Molecular Properties

Compound Namecyclobuten-1-yl(naphthalen-2-yl)methanone
PubChem CID102414446
Molecular FormulaC15H12O
Molecular Weight208.26 g/mol
Exact Mass208.09
IUPAC Namecyclobuten-1-yl(naphthalen-2-yl)methanone
SMILESO=C(C1=CCC1)c1ccc2ccccc2c1
InChIInChI=1S/C15H12O/c16-15(12-6-3-7-12)14-9-8-11-4-1-2-5-13(11)10-14/h1-2,4-6,8-10H,3,7H2
InChIKeyJBUANDQPYDOMLU-UHFFFAOYSA-N
XLogP3.74
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexen-1-yl(naphthalen-2-yl)methanone
CID 62078640
dinaphthalen-2-ylmethanone
CID 10945915
naphthalen-2-yl(phenyl)(113C)methanone
CID 101359138
1-naphthalen-2-yl-2-[4-(2-naphthalen-2-yl-2-oxoacetyl)phenyl]ethane-1,2-dione
CID 10939145
2,3-dihydrofuran-5-yl(naphthalen-2-yl)methanone
CID 10775502
2,3-dihydro-1H-inden-5-yl(naphthalen-2-yl)methanone
CID 43338934
naphthalene-2-carboxylic acid
CID 175967775
2-naphthalen-2-yl-2-oxoacetyl chloride
CID 19347531
(6-bromonaphthalen-2-yl)-(cyclohexen-1-yl)methanone
CID 115353718
naphthalene-2-carboxylic acid;dihydrochloride
CID 70357946
(3-methylphenyl)-naphthalen-2-ylmethanone
CID 15552635
formaldehyde;naphthalene-2-carboxylic acid
CID 86738660

Frequently Asked Questions

What is the IUPAC name of cyclobuten-1-yl(naphthalen-2-yl)methanone?
The IUPAC name of cyclobuten-1-yl(naphthalen-2-yl)methanone (CID 102414446) is cyclobuten-1-yl(naphthalen-2-yl)methanone.
What is the SMILES notation for cyclobuten-1-yl(naphthalen-2-yl)methanone?
The canonical SMILES for cyclobuten-1-yl(naphthalen-2-yl)methanone is O=C(C1=CCC1)c1ccc2ccccc2c1.
What is the InChIKey of cyclobuten-1-yl(naphthalen-2-yl)methanone?
The InChIKey is JBUANDQPYDOMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O/c16-15(12-6-3-7-12)14-9-8-11-4-1-2-5-13(11)10-14/h1-2,4-6,8-10H,3,7H2.
What are the key properties of cyclobuten-1-yl(naphthalen-2-yl)methanone?
cyclobuten-1-yl(naphthalen-2-yl)methanone has a molecular weight of 208.26 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobuten-1-yl(naphthalen-2-yl)methanone is sourced from PubChem (CID 102414446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).