2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide

C14H10ClFN4O2 — CID 134493630

IUPAC2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide
SMILESNC(=O)Cn1c(=O)[nH]c2ncc(-c3ccc(F)c(Cl)c3)cc21
InChIInChI=1S/C14H10ClFN4O2/c15-9-3-7(1-2-10(9)16)8-4-11-13(18-5-8)19-14(22)20(11)6-12(17)21/h1-5H,6H2,(H2,17,21)(H,18,19,22)
InChIKeyUYLPYPVXCJIAEP-UHFFFAOYSA-N
MW320.71 g/mol
LogP1.67
Rot. Bonds3

About 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide

2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide (PubChem CID 134493630) has the molecular formula C14H10ClFN4O2 and a molecular weight of 320.71 g/mol. Its IUPAC name is 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide.

Molecular Properties

Compound Name2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide
PubChem CID134493630
Molecular FormulaC14H10ClFN4O2
Molecular Weight320.71 g/mol
Exact Mass320.05
IUPAC Name2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide
SMILESNC(=O)Cn1c(=O)[nH]c2ncc(-c3ccc(F)c(Cl)c3)cc21
InChIInChI=1S/C14H10ClFN4O2/c15-9-3-7(1-2-10(9)16)8-4-11-13(18-5-8)19-14(22)20(11)6-12(17)21/h1-5H,6H2,(H2,17,21)(H,18,19,22)
InChIKeyUYLPYPVXCJIAEP-UHFFFAOYSA-N
XLogP1.67
TPSA93.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.71
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide with MolForge

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Related Compounds

2-[1-[2-(5-Chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-2-oxoimidazo[4,5-c]pyridin-3-yl]acetamide
CID 145925651
5-chloro-N-(pyridin-3-yl)indoline-1-carboxamide
CID 10826147
1-Methyl-6-Phenyl-1,3-Dihydro-2h-Imidazo[4,5-B]pyridin-2-One
CID 4153551
US10617676, Example 408
CID 134490113
US10617676, Example 419
CID 134490124
US10617676, Example 20
CID 134493705
2-(3-chloro-6-oxo-6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)-N-(2-ethylphenyl)acetamide
CID 3237683
N-[5-(3-fluorophenyl)-1-methyl-2-oxo-3-pyridinyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CID 44455043
N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3-pyridinyl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CID 44455078
N-[3-(3-chloro-4-fluorophenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]acetamide
CID 49791274
2-(3-Chlorophenyl)-3H-imidazo[4,5-b]pyridine-3-acetamide
CID 14676655
US9669031, 28 3-(3-chloro-5-fluorophenyl)-3-methyl-6-(pyrimidin-4-ylamino)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione (Cpd. No. 28)
CID 118599074

Frequently Asked Questions

What is the IUPAC name of 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide?
The IUPAC name of 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide (CID 134493630) is 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide.
What is the SMILES notation for 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide?
The canonical SMILES for 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide is NC(=O)Cn1c(=O)[nH]c2ncc(-c3ccc(F)c(Cl)c3)cc21.
What is the InChIKey of 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide?
The InChIKey is UYLPYPVXCJIAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFN4O2/c15-9-3-7(1-2-10(9)16)8-4-11-13(18-5-8)19-14(22)20(11)6-12(17)21/h1-5H,6H2,(H2,17,21)(H,18,19,22).
What are the key properties of 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide?
2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide has a molecular weight of 320.71 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-chloro-4-fluorophenyl)-2-oxo-3H-imidazo[4,5-b]pyridin-1-yl]acetamide is sourced from PubChem (CID 134493630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).