2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one

C10H7BrN4O — CID 171801635

IUPAC2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one
SMILESO=C1N(c2cccnc2)Cc2nc(Br)cn21
InChIInChI=1S/C10H7BrN4O/c11-8-5-15-9(13-8)6-14(10(15)16)7-2-1-3-12-4-7/h1-5H,6H2
InChIKeyCKFAOEGMWAYJSE-UHFFFAOYSA-N
MW279.10 g/mol
LogP2.03
Rot. Bonds1

About 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one

2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one (PubChem CID 171801635) has the molecular formula C10H7BrN4O and a molecular weight of 279.10 g/mol. Its IUPAC name is 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one.

Molecular Properties

Compound Name2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one
PubChem CID171801635
Molecular FormulaC10H7BrN4O
Molecular Weight279.10 g/mol
Exact Mass277.98
IUPAC Name2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one
SMILESO=C1N(c2cccnc2)Cc2nc(Br)cn21
InChIInChI=1S/C10H7BrN4O/c11-8-5-15-9(13-8)6-14(10(15)16)7-2-1-3-12-4-7/h1-5H,6H2
InChIKeyCKFAOEGMWAYJSE-UHFFFAOYSA-N
XLogP2.03
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.10
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-pyridin-3-yl-2-(6-pyrrolidin-1-yl-3-pyridinyl)-7H-imidazo[1,2-c]imidazol-5-one;hydrofluoride
CID 171801653
1-(4-methyl-3-pyridinyl)-3-pyridin-3-ylimidazolidin-2-one
CID 163559526
4-bromo-1-pyridin-3-ylpyridin-2-one
CID 124927167
2-pyridin-3-yl-3H-pyrrolo[3,4-b]quinolin-1-one
CID 69242235
(1R,2S,6R,7R,8S,9R)-8,9-dibromo-4-pyridin-3-yl-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
CID 124725203
1-pyridin-3-ylpyrrolidine-2,5-dione
CID 2737832
4-(2-bromophenyl)sulfonyl-1-pyridin-3-ylpiperazin-2-one
CID 126855640
3-(4-bromoimidazol-1-yl)pyridine
CID 66520793
1-pyridin-3-yl-3-[4-(2,2,2-trifluoroethyl)phenyl]imidazolidin-2-one
CID 150091015
5-hydroxy-3-pyridin-3-yl-1H-imidazol-2-one
CID 57110484
6-bromo-4-methyl-2-pyridin-3-yl-1,2,4-triazine-3,5-dione
CID 67159541
3-bromo-1-pyridin-3-yl-3H-pyrrol-2-one
CID 174823546

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one?
The IUPAC name of 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one (CID 171801635) is 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one.
What is the SMILES notation for 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one?
The canonical SMILES for 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one is O=C1N(c2cccnc2)Cc2nc(Br)cn21.
What is the InChIKey of 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one?
The InChIKey is CKFAOEGMWAYJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN4O/c11-8-5-15-9(13-8)6-14(10(15)16)7-2-1-3-12-4-7/h1-5H,6H2.
What are the key properties of 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one?
2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one has a molecular weight of 279.10 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-pyridin-3-yl-7H-imidazo[1,2-c]imidazol-5-one is sourced from PubChem (CID 171801635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).