N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine

C15H15FN2O2 — CID 126016404

IUPACN-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine
SMILESFc1ccc(/N=C/c2ccc(N3CCOCC3)o2)cc1
InChIInChI=1S/C15H15FN2O2/c16-12-1-3-13(4-2-12)17-11-14-5-6-15(20-14)18-7-9-19-10-8-18/h1-6,11H,7-10H2/b17-11+
InChIKeyIIUCNVVNKDFRQO-GZTJUZNOSA-N
MW274.30 g/mol
LogP3.01
Rot. Bonds3

About N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine

N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine (PubChem CID 126016404) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine
PubChem CID126016404
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC NameN-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine
SMILESFc1ccc(/N=C/c2ccc(N3CCOCC3)o2)cc1
InChIInChI=1S/C15H15FN2O2/c16-12-1-3-13(4-2-12)17-11-14-5-6-15(20-14)18-7-9-19-10-8-18/h1-6,11H,7-10H2/b17-11+
InChIKeyIIUCNVVNKDFRQO-GZTJUZNOSA-N
XLogP3.01
TPSA37.97 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine?
The IUPAC name of N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine (CID 126016404) is N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine.
What is the SMILES notation for N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine?
The canonical SMILES for N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine is Fc1ccc(/N=C/c2ccc(N3CCOCC3)o2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine?
The InChIKey is IIUCNVVNKDFRQO-GZTJUZNOSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-12-1-3-13(4-2-12)17-11-14-5-6-15(20-14)18-7-9-19-10-8-18/h1-6,11H,7-10H2/b17-11+.
What are the key properties of N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine?
N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine has a molecular weight of 274.30 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-(5-morpholin-4-ylfuran-2-yl)methanimine is sourced from PubChem (CID 126016404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).