bis(2-cyclopropyl-3-fluorophenyl)methanone

C19H16F2O — CID 73011767

IUPACbis(2-cyclopropyl-3-fluorophenyl)methanone
SMILESO=C(c1cccc(F)c1C1CC1)c1cccc(F)c1C1CC1
InChIInChI=1S/C19H16F2O/c20-15-5-1-3-13(17(15)11-7-8-11)19(22)14-4-2-6-16(21)18(14)12-9-10-12/h1-6,11-12H,7-10H2
InChIKeyMYHXTUXDVQAHOM-UHFFFAOYSA-N
MW298.33 g/mol
LogP4.95
Rot. Bonds4

About bis(2-cyclopropyl-3-fluorophenyl)methanone

bis(2-cyclopropyl-3-fluorophenyl)methanone (PubChem CID 73011767) has the molecular formula C19H16F2O and a molecular weight of 298.33 g/mol. Its IUPAC name is bis(2-cyclopropyl-3-fluorophenyl)methanone.

Molecular Properties

Compound Namebis(2-cyclopropyl-3-fluorophenyl)methanone
PubChem CID73011767
Molecular FormulaC19H16F2O
Molecular Weight298.33 g/mol
Exact Mass298.12
IUPAC Namebis(2-cyclopropyl-3-fluorophenyl)methanone
SMILESO=C(c1cccc(F)c1C1CC1)c1cccc(F)c1C1CC1
InChIInChI=1S/C19H16F2O/c20-15-5-1-3-13(17(15)11-7-8-11)19(22)14-4-2-6-16(21)18(14)12-9-10-12/h1-6,11-12H,7-10H2
InChIKeyMYHXTUXDVQAHOM-UHFFFAOYSA-N
XLogP4.95
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze bis(2-cyclopropyl-3-fluorophenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Cyclohexyl phenyl ketone
CID 12837
4,4'-Difluorobenzophenone
CID 9582
5H-Dibenzo[a,d]cyclohepten-5-one
CID 16679
4,4'-Difluorobenzil
CID 123072
Dibenzosuberone
CID 14589
4-Phenylbutyrophenone
CID 79413
2,4,6-Trimethylbenzophenone
CID 70380
3'-(Trifluoromethyl)chalcone
CID 6115271
4-Fluorochalcone
CID 5366988
2-Methylbenzophenone
CID 67230
4'-(Trifluoromethyl)chalcone
CID 11219604
1,2-Bis(2,4-difluorophenyl)ethane-1,2-dione
CID 19377173

Frequently Asked Questions

What is the IUPAC name of bis(2-cyclopropyl-3-fluorophenyl)methanone?
The IUPAC name of bis(2-cyclopropyl-3-fluorophenyl)methanone (CID 73011767) is bis(2-cyclopropyl-3-fluorophenyl)methanone.
What is the SMILES notation for bis(2-cyclopropyl-3-fluorophenyl)methanone?
The canonical SMILES for bis(2-cyclopropyl-3-fluorophenyl)methanone is O=C(c1cccc(F)c1C1CC1)c1cccc(F)c1C1CC1.
What is the InChIKey of bis(2-cyclopropyl-3-fluorophenyl)methanone?
The InChIKey is MYHXTUXDVQAHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2O/c20-15-5-1-3-13(17(15)11-7-8-11)19(22)14-4-2-6-16(21)18(14)12-9-10-12/h1-6,11-12H,7-10H2.
What are the key properties of bis(2-cyclopropyl-3-fluorophenyl)methanone?
bis(2-cyclopropyl-3-fluorophenyl)methanone has a molecular weight of 298.33 g/mol, XLogP of 4.95, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-cyclopropyl-3-fluorophenyl)methanone is sourced from PubChem (CID 73011767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).