2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile

C19H15FN2O — CID 58016865

IUPAC2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile
SMILESCCc1ccc(-c2c(-c3ccccc3F)oc(N)c2C#N)cc1
InChIInChI=1S/C19H15FN2O/c1-2-12-7-9-13(10-8-12)17-15(11-21)19(22)23-18(17)14-5-3-4-6-16(14)20/h3-10H,2,22H2,1H3
InChIKeyOGZNHJMOIZUHOM-UHFFFAOYSA-N
MW306.34 g/mol
LogP4.77
Rot. Bonds3

About 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile

2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile (PubChem CID 58016865) has the molecular formula C19H15FN2O and a molecular weight of 306.34 g/mol. Its IUPAC name is 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile
PubChem CID58016865
Molecular FormulaC19H15FN2O
Molecular Weight306.34 g/mol
Exact Mass306.12
IUPAC Name2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile
SMILESCCc1ccc(-c2c(-c3ccccc3F)oc(N)c2C#N)cc1
InChIInChI=1S/C19H15FN2O/c1-2-12-7-9-13(10-8-12)17-15(11-21)19(22)23-18(17)14-5-3-4-6-16(14)20/h3-10H,2,22H2,1H3
InChIKeyOGZNHJMOIZUHOM-UHFFFAOYSA-N
XLogP4.77
TPSA62.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile?
The IUPAC name of 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile (CID 58016865) is 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile?
The canonical SMILES for 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile is CCc1ccc(-c2c(-c3ccccc3F)oc(N)c2C#N)cc1.
What is the InChIKey of 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile?
The InChIKey is OGZNHJMOIZUHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O/c1-2-12-7-9-13(10-8-12)17-15(11-21)19(22)23-18(17)14-5-3-4-6-16(14)20/h3-10H,2,22H2,1H3.
What are the key properties of 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile?
2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile has a molecular weight of 306.34 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-ethylphenyl)-5-(2-fluorophenyl)furan-3-carbonitrile is sourced from PubChem (CID 58016865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).