2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide

C21H17FN4O2 — CID 24784328

IUPAC2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESO=C(NCCc1cccc(O)c1)c1ccnc2nc(-c3ccc(F)cc3)[nH]c12
InChIInChI=1S/C21H17FN4O2/c22-15-6-4-14(5-7-15)19-25-18-17(9-11-23-20(18)26-19)21(28)24-10-8-13-2-1-3-16(27)12-13/h1-7,9,11-12,27H,8,10H2,(H,24,28)(H,23,25,26)
InChIKeyUJQFOUYJDYVEIK-UHFFFAOYSA-N
MW376.39 g/mol
LogP3.44
Rot. Bonds5

About 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide

2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide (PubChem CID 24784328) has the molecular formula C21H17FN4O2 and a molecular weight of 376.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
PubChem CID24784328
Molecular FormulaC21H17FN4O2
Molecular Weight376.39 g/mol
Exact Mass376.13
IUPAC Name2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESO=C(NCCc1cccc(O)c1)c1ccnc2nc(-c3ccc(F)cc3)[nH]c12
InChIInChI=1S/C21H17FN4O2/c22-15-6-4-14(5-7-15)19-25-18-17(9-11-23-20(18)26-19)21(28)24-10-8-13-2-1-3-16(27)12-13/h1-7,9,11-12,27H,8,10H2,(H,24,28)(H,23,25,26)
InChIKeyUJQFOUYJDYVEIK-UHFFFAOYSA-N
XLogP3.44
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 53.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide (CID 24784328) is 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide is O=C(NCCc1cccc(O)c1)c1ccnc2nc(-c3ccc(F)cc3)[nH]c12.
What is the InChIKey of 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The InChIKey is UJQFOUYJDYVEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O2/c22-15-6-4-14(5-7-15)19-25-18-17(9-11-23-20(18)26-19)21(28)24-10-8-13-2-1-3-16(27)12-13/h1-7,9,11-12,27H,8,10H2,(H,24,28)(H,23,25,26).
What are the key properties of 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide?
2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide has a molecular weight of 376.39 g/mol, XLogP of 3.44, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[2-(3-hydroxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide is sourced from PubChem (CID 24784328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).