N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide

C21H19N5O3 — CID 143508177

IUPACN-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESCc1ccc(-c2nc3nccc(C(=O)NCCn4ccc(O)cc4=O)c3[nH]2)cc1
InChIInChI=1S/C21H19N5O3/c1-13-2-4-14(5-3-13)19-24-18-16(6-8-22-20(18)25-19)21(29)23-9-11-26-10-7-15(27)12-17(26)28/h2-8,10,12,27H,9,11H2,1H3,(H,23,29)(H,22,24,25)
InChIKeyNAFDOKXESHEHOH-UHFFFAOYSA-N
MW389.42 g/mol
LogP2.23
Rot. Bonds5

About N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide

N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide (PubChem CID 143508177) has the molecular formula C21H19N5O3 and a molecular weight of 389.42 g/mol. Its IUPAC name is N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
PubChem CID143508177
Molecular FormulaC21H19N5O3
Molecular Weight389.42 g/mol
Exact Mass389.15
IUPAC NameN-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESCc1ccc(-c2nc3nccc(C(=O)NCCn4ccc(O)cc4=O)c3[nH]2)cc1
InChIInChI=1S/C21H19N5O3/c1-13-2-4-14(5-3-13)19-24-18-16(6-8-22-20(18)25-19)21(29)23-9-11-26-10-7-15(27)12-17(26)28/h2-8,10,12,27H,9,11H2,1H3,(H,23,29)(H,22,24,25)
InChIKeyNAFDOKXESHEHOH-UHFFFAOYSA-N
XLogP2.23
TPSA112.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.42
LogP ≤ 52.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The IUPAC name of N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide (CID 143508177) is N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The canonical SMILES for N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide is Cc1ccc(-c2nc3nccc(C(=O)NCCn4ccc(O)cc4=O)c3[nH]2)cc1.
What is the InChIKey of N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The InChIKey is NAFDOKXESHEHOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O3/c1-13-2-4-14(5-3-13)19-24-18-16(6-8-22-20(18)25-19)21(29)23-9-11-26-10-7-15(27)12-17(26)28/h2-8,10,12,27H,9,11H2,1H3,(H,23,29)(H,22,24,25).
What are the key properties of N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide?
N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide has a molecular weight of 389.42 g/mol, XLogP of 2.23, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxy-2-oxo-1-pyridinyl)ethyl]-2-(4-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxamide is sourced from PubChem (CID 143508177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).