2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone

C15H12ClN5O2 — CID 99792675

IUPAC2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone
SMILESO=C(COc1cncc(Cl)n1)N1CCn2c1nc1ccccc12
InChIInChI=1S/C15H12ClN5O2/c16-12-7-17-8-13(19-12)23-9-14(22)21-6-5-20-11-4-2-1-3-10(11)18-15(20)21/h1-4,7-8H,5-6,9H2
InChIKeyIPOSFFVGCKBPMB-UHFFFAOYSA-N
MW329.75 g/mol
LogP1.91
Rot. Bonds3

About 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone

2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone (PubChem CID 99792675) has the molecular formula C15H12ClN5O2 and a molecular weight of 329.75 g/mol. Its IUPAC name is 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone.

Molecular Properties

Compound Name2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone
PubChem CID99792675
Molecular FormulaC15H12ClN5O2
Molecular Weight329.75 g/mol
Exact Mass329.07
IUPAC Name2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone
SMILESO=C(COc1cncc(Cl)n1)N1CCn2c1nc1ccccc12
InChIInChI=1S/C15H12ClN5O2/c16-12-7-17-8-13(19-12)23-9-14(22)21-6-5-20-11-4-2-1-3-10(11)18-15(20)21/h1-4,7-8H,5-6,9H2
InChIKeyIPOSFFVGCKBPMB-UHFFFAOYSA-N
XLogP1.91
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.75
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[4-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbonyl)piperidin-1-yl]-2-phenoxyethanone
CID 112820521
3-(3-chloro-4-methylphenyl)-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)propan-1-one
CID 36567964
(1-aminocyclopentyl)-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)methanone;hydrochloride
CID 119265439
(2,4-dichlorophenyl)-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)methanone
CID 975542
2-(3-bromo-2-fluorophenyl)-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone
CID 146022552
1-[4-(1,2-dihydroimidazo[1,2-a]benzimidazole-3-carbonyl)piperidin-1-yl]-3-phenoxypropan-1-one
CID 112844277
1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl-(4-methylphenyl)methanone
CID 791787
[1-(1,3-benzothiazol-2-yl)azetidin-3-yl]-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)methanone
CID 90603946
(2-chlorophenyl)-(3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-1-yl)methanone
CID 66504683
N-[4-[2-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)-2-oxoethyl]-1,3-thiazol-2-yl]benzamide
CID 36568162
(4-tert-butylphenyl)-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)methanone
CID 2435970
1-(4-chlorophenyl)-2-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone
CID 23847688

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone?
The IUPAC name of 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone (CID 99792675) is 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone.
What is the SMILES notation for 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone?
The canonical SMILES for 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone is O=C(COc1cncc(Cl)n1)N1CCn2c1nc1ccccc12.
What is the InChIKey of 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone?
The InChIKey is IPOSFFVGCKBPMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN5O2/c16-12-7-17-8-13(19-12)23-9-14(22)21-6-5-20-11-4-2-1-3-10(11)18-15(20)21/h1-4,7-8H,5-6,9H2.
What are the key properties of 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone?
2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone has a molecular weight of 329.75 g/mol, XLogP of 1.91, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloropyrazin-2-yl)oxy-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)ethanone is sourced from PubChem (CID 99792675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).