cyclopropyl-(2-fluoro-3-methylphenyl)methanone

C11H11FO — CID 70266703

IUPACcyclopropyl-(2-fluoro-3-methylphenyl)methanone
SMILESCc1cccc(C(=O)C2CC2)c1F
InChIInChI=1S/C11H11FO/c1-7-3-2-4-9(10(7)12)11(13)8-5-6-8/h2-4,8H,5-6H2,1H3
InChIKeyFXUOYUROQTWSFG-UHFFFAOYSA-N
MW178.21 g/mol
LogP2.73
Rot. Bonds2

About cyclopropyl-(2-fluoro-3-methylphenyl)methanone

cyclopropyl-(2-fluoro-3-methylphenyl)methanone (PubChem CID 70266703) has the molecular formula C11H11FO and a molecular weight of 178.21 g/mol. Its IUPAC name is cyclopropyl-(2-fluoro-3-methylphenyl)methanone.

Molecular Properties

Compound Namecyclopropyl-(2-fluoro-3-methylphenyl)methanone
PubChem CID70266703
Molecular FormulaC11H11FO
Molecular Weight178.21 g/mol
Exact Mass178.08
IUPAC Namecyclopropyl-(2-fluoro-3-methylphenyl)methanone
SMILESCc1cccc(C(=O)C2CC2)c1F
InChIInChI=1S/C11H11FO/c1-7-3-2-4-9(10(7)12)11(13)8-5-6-8/h2-4,8H,5-6H2,1H3
InChIKeyFXUOYUROQTWSFG-UHFFFAOYSA-N
XLogP2.73
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(2-fluoro-3-methylphenyl)methanone?
The IUPAC name of cyclopropyl-(2-fluoro-3-methylphenyl)methanone (CID 70266703) is cyclopropyl-(2-fluoro-3-methylphenyl)methanone.
What is the SMILES notation for cyclopropyl-(2-fluoro-3-methylphenyl)methanone?
The canonical SMILES for cyclopropyl-(2-fluoro-3-methylphenyl)methanone is Cc1cccc(C(=O)C2CC2)c1F.
What is the InChIKey of cyclopropyl-(2-fluoro-3-methylphenyl)methanone?
The InChIKey is FXUOYUROQTWSFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FO/c1-7-3-2-4-9(10(7)12)11(13)8-5-6-8/h2-4,8H,5-6H2,1H3.
What are the key properties of cyclopropyl-(2-fluoro-3-methylphenyl)methanone?
cyclopropyl-(2-fluoro-3-methylphenyl)methanone has a molecular weight of 178.21 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(2-fluoro-3-methylphenyl)methanone is sourced from PubChem (CID 70266703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).