N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide

C19H15FN6O — CID 25138294

IUPACN-[5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide
SMILESCC1=C(C=CC(=N1)C2=C(N=C(N2)NC(=O)C)C3=CC4=NC=CN=C4C=C3)F
InChIInChI=1S/C19H15FN6O/c1-10-13(20)4-6-15(23-10)18-17(25-19(26-18)24-11(2)27)12-3-5-14-16(9-12)22-8-7-21-14/h3-9H,1-2H3,(H2,24,25,26,27)
InChIKeyTYPILNNEZPSNTI-UHFFFAOYSA-N
MW362.40 g/mol
LogP1.60
Rot. Bonds3

About N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide

N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide (PubChem CID 25138294) has the molecular formula C19H15FN6O and a molecular weight of 362.40 g/mol. Its IUPAC name is N-[5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide
PubChem CID25138294
Molecular FormulaC19H15FN6O
Molecular Weight362.40 g/mol
Exact Mass362.13
IUPAC NameN-[5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide
SMILESCC1=C(C=CC(=N1)C2=C(N=C(N2)NC(=O)C)C3=CC4=NC=CN=C4C=C3)F
InChIInChI=1S/C19H15FN6O/c1-10-13(20)4-6-15(23-10)18-17(25-19(26-18)24-11(2)27)12-3-5-14-16(9-12)22-8-7-21-14/h3-9H,1-2H3,(H2,24,25,26,27)
InChIKeyTYPILNNEZPSNTI-UHFFFAOYSA-N
XLogP1.60
TPSA96.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity536

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,2'-Di-4-pyridinyl-5,5'-bi-1H-benzimidazole
CID 16659285
PF-4708671
CID 51371303
SB-525334
CID 9967941
IN-1130
CID 11676119
4-[7-(4-fluorophenyl)-5H-pyrrolo[3,2-d]pyrimidin-6-yl]pyridine
CID 11098241
1-ethyl-3-[7-(2-pyridyl)-5-(3-pyridyl)-1H-benzimidazol-2-yl]urea
CID 11428309
1-Ethyl-3-[5-(5-Fluoropyridin-3-Yl)-7-(Pyrimidin-2-Yl)-1h-Benzimidazol-2-Yl]urea
CID 11494578
2-(4-methyl-1H-1,3-benzodiazol-2-yl)quinoxaline
CID 11521761
3-ethyl-1-[7-(3-fluoropyridin-2-yl)-5-(pyridin-3-yl)-1H-1,3-benzodiazol-2-yl]urea
CID 11646514
IN-1166
CID 16654987
3-ethyl-1-[5-(pyridin-3-yl)-1H-1,3-benzodiazol-2-yl]urea
CID 21365956
3-ethyl-1-[6-(piperidin-1-yl)-5-(pyridin-3-yl)-1H-1,3-benzodiazol-2-yl]urea
CID 21365983

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide?
The IUPAC name of N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide (CID 25138294) is N-[5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide.
What is the SMILES notation for N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide?
The canonical SMILES for N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide is CC1=C(C=CC(=N1)C2=C(N=C(N2)NC(=O)C)C3=CC4=NC=CN=C4C=C3)F.
What is the InChIKey of N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide?
The InChIKey is TYPILNNEZPSNTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN6O/c1-10-13(20)4-6-15(23-10)18-17(25-19(26-18)24-11(2)27)12-3-5-14-16(9-12)22-8-7-21-14/h3-9H,1-2H3,(H2,24,25,26,27).
What are the key properties of N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide?
N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide has a molecular weight of 362.40 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-fluoro-6-methylpyridin-2-yl)-5-quinoxalin-6-yl-1H-imidazol-2-yl]acetamide is sourced from PubChem (CID 25138294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).