N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene

C20H18F2N2O — CID 174988717

IUPACN-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene
SMILESCCNC(=O)c1ccc(-c2ccc(F)cc2)cn1.Fc1ccccc1
InChIInChI=1S/C14H13FN2O.C6H5F/c1-2-16-14(18)13-8-5-11(9-17-13)10-3-6-12(15)7-4-10;7-6-4-2-1-3-5-6/h3-9H,2H2,1H3,(H,16,18);1-5H
InChIKeyPUAYSYGXXSMMNC-UHFFFAOYSA-N
MW340.37 g/mol
LogP4.46
Rot. Bonds3

About N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene

N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene (PubChem CID 174988717) has the molecular formula C20H18F2N2O and a molecular weight of 340.37 g/mol. Its IUPAC name is N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene.

Molecular Properties

Compound NameN-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene
PubChem CID174988717
Molecular FormulaC20H18F2N2O
Molecular Weight340.37 g/mol
Exact Mass340.14
IUPAC NameN-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene
SMILESCCNC(=O)c1ccc(-c2ccc(F)cc2)cn1.Fc1ccccc1
InChIInChI=1S/C14H13FN2O.C6H5F/c1-2-16-14(18)13-8-5-11(9-17-13)10-3-6-12(15)7-4-10;7-6-4-2-1-3-5-6/h3-9H,2H2,1H3,(H,16,18);1-5H
InChIKeyPUAYSYGXXSMMNC-UHFFFAOYSA-N
XLogP4.46
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.37
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene 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 N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene?
The IUPAC name of N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene (CID 174988717) is N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene.
What is the SMILES notation for N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene?
The canonical SMILES for N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene is CCNC(=O)c1ccc(-c2ccc(F)cc2)cn1.Fc1ccccc1.
What is the InChIKey of N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene?
The InChIKey is PUAYSYGXXSMMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O.C6H5F/c1-2-16-14(18)13-8-5-11(9-17-13)10-3-6-12(15)7-4-10;7-6-4-2-1-3-5-6/h3-9H,2H2,1H3,(H,16,18);1-5H.
What are the key properties of N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene?
N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene has a molecular weight of 340.37 g/mol, XLogP of 4.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(4-fluorophenyl)pyridine-2-carboxamide;fluorobenzene is sourced from PubChem (CID 174988717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).