4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one

C17H14FNO2 — CID 59073346

IUPAC4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one
SMILESCNC1=C(c2cccc(F)c2)C(=O)C(c2ccccc2)O1
InChIInChI=1S/C17H14FNO2/c1-19-17-14(12-8-5-9-13(18)10-12)15(20)16(21-17)11-6-3-2-4-7-11/h2-10,16,19H,1H3
InChIKeyBNSPZEMUYMTMBU-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.05
Rot. Bonds3

About 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one

4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one (PubChem CID 59073346) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one.

Molecular Properties

Compound Name4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one
PubChem CID59073346
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one
SMILESCNC1=C(c2cccc(F)c2)C(=O)C(c2ccccc2)O1
InChIInChI=1S/C17H14FNO2/c1-19-17-14(12-8-5-9-13(18)10-12)15(20)16(21-17)11-6-3-2-4-7-11/h2-10,16,19H,1H3
InChIKeyBNSPZEMUYMTMBU-UHFFFAOYSA-N
XLogP3.05
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one 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

Flurtamone
CID 91755
(R)-flurtamone
CID 92286492
5-(methylamino)-2-phenyl-4-[4-(trifluoromethyl)phenyl]-3(2H)-furanone
CID 2765920
2-Phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-amino-2,3-dihydrofuran
CID 13579285
5-(Ethylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]furan-3-one
CID 13579287
5-Amino-2-(4-fluorophenyl)-4-[3-(trifluoromethyl)phenyl]furan-3-one
CID 13579289
5-(Methylamino)-2-naphthalen-1-yl-4-[3-(trifluoromethyl)phenyl]furan-3-one
CID 13579310
2-Methyl-5-(methylamino)-4-[3-(trifluoromethyl)phenyl]furan-3-one
CID 13579313
2-Ethyl-5-(methylamino)-4-[3-(trifluoromethyl)phenyl]furan-3-one
CID 13579316
2-Phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-cyclopropylamino-2,3-dihydrofuran
CID 13579376
4-[4-Chloro-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenylfuran-3-one
CID 20205357
2-(4-Fluorophenyl)-5-(methylamino)-4-[3-(trifluoromethyl)phenyl]furan-3-one
CID 20205358

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one?
The IUPAC name of 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one (CID 59073346) is 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one.
What is the SMILES notation for 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one?
The canonical SMILES for 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one is CNC1=C(c2cccc(F)c2)C(=O)C(c2ccccc2)O1.
What is the InChIKey of 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one?
The InChIKey is BNSPZEMUYMTMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-19-17-14(12-8-5-9-13(18)10-12)15(20)16(21-17)11-6-3-2-4-7-11/h2-10,16,19H,1H3.
What are the key properties of 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one?
4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one has a molecular weight of 283.30 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-5-(methylamino)-2-phenylfuran-3-one is sourced from PubChem (CID 59073346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).