N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide

C18H15FN2O2 — CID 155530767

IUPACN-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(-c2ccco2)cn1
InChIInChI=1S/C18H15FN2O2/c19-15-5-2-1-4-13(15)9-10-20-18(22)16-8-7-14(12-21-16)17-6-3-11-23-17/h1-8,11-12H,9-10H2,(H,20,22)
InChIKeyJCGPUYMYTKNRLK-UHFFFAOYSA-N
MW310.33 g/mol
LogP3.45
Rot. Bonds5

About N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide

N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide (PubChem CID 155530767) has the molecular formula C18H15FN2O2 and a molecular weight of 310.33 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide
PubChem CID155530767
Molecular FormulaC18H15FN2O2
Molecular Weight310.33 g/mol
Exact Mass310.11
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(-c2ccco2)cn1
InChIInChI=1S/C18H15FN2O2/c19-15-5-2-1-4-13(15)9-10-20-18(22)16-8-7-14(12-21-16)17-6-3-11-23-17/h1-8,11-12H,9-10H2,(H,20,22)
InChIKeyJCGPUYMYTKNRLK-UHFFFAOYSA-N
XLogP3.45
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide (CID 155530767) is N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide is O=C(NCCc1ccccc1F)c1ccc(-c2ccco2)cn1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide?
The InChIKey is JCGPUYMYTKNRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O2/c19-15-5-2-1-4-13(15)9-10-20-18(22)16-8-7-14(12-21-16)17-6-3-11-23-17/h1-8,11-12H,9-10H2,(H,20,22).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide has a molecular weight of 310.33 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 155530767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).