N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide

C20H17FN2O2 — CID 155525051

IUPACN-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(-c2ccc(O)cc2)cn1
InChIInChI=1S/C20H17FN2O2/c21-18-4-2-1-3-15(18)11-12-22-20(25)19-10-7-16(13-23-19)14-5-8-17(24)9-6-14/h1-10,13,24H,11-12H2,(H,22,25)
InChIKeyXTHAAJIZENVBBA-UHFFFAOYSA-N
MW336.37 g/mol
LogP3.57
Rot. Bonds5

About N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide

N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide (PubChem CID 155525051) has the molecular formula C20H17FN2O2 and a molecular weight of 336.37 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide
PubChem CID155525051
Molecular FormulaC20H17FN2O2
Molecular Weight336.37 g/mol
Exact Mass336.13
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(-c2ccc(O)cc2)cn1
InChIInChI=1S/C20H17FN2O2/c21-18-4-2-1-3-15(18)11-12-22-20(25)19-10-7-16(13-23-19)14-5-8-17(24)9-6-14/h1-10,13,24H,11-12H2,(H,22,25)
InChIKeyXTHAAJIZENVBBA-UHFFFAOYSA-N
XLogP3.57
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide (CID 155525051) is N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide is O=C(NCCc1ccccc1F)c1ccc(-c2ccc(O)cc2)cn1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide?
The InChIKey is XTHAAJIZENVBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O2/c21-18-4-2-1-3-15(18)11-12-22-20(25)19-10-7-16(13-23-19)14-5-8-17(24)9-6-14/h1-10,13,24H,11-12H2,(H,22,25).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide has a molecular weight of 336.37 g/mol, XLogP of 3.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-5-(4-hydroxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 155525051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).