6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one

C17H11BrN2O2 — CID 1119394

IUPAC6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
SMILESCc1cccn2cc(-c3cc4cc(Br)ccc4oc3=O)nc12
InChIInChI=1S/C17H11BrN2O2/c1-10-3-2-6-20-9-14(19-16(10)20)13-8-11-7-12(18)4-5-15(11)22-17(13)21/h2-9H,1H3
InChIKeyAEWDTCBLNYSLIE-UHFFFAOYSA-N
MW355.19 g/mol
LogP4.18
Rot. Bonds1

About 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one

6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one (PubChem CID 1119394) has the molecular formula C17H11BrN2O2 and a molecular weight of 355.19 g/mol. Its IUPAC name is 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one.

Molecular Properties

Compound Name6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
PubChem CID1119394
Molecular FormulaC17H11BrN2O2
Molecular Weight355.19 g/mol
Exact Mass354.00
IUPAC Name6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
SMILESCc1cccn2cc(-c3cc4cc(Br)ccc4oc3=O)nc12
InChIInChI=1S/C17H11BrN2O2/c1-10-3-2-6-20-9-14(19-16(10)20)13-8-11-7-12(18)4-5-15(11)22-17(13)21/h2-9H,1H3
InChIKeyAEWDTCBLNYSLIE-UHFFFAOYSA-N
XLogP4.18
TPSA47.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.19
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

6-bromo-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-oxochromene-3-carboxamide
CID 121149115
7-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
CID 71621549
2-(5-bromo-1-benzofuran-2-yl)-8-methoxyimidazo[1,2-a]pyridine
CID 115404774
2-(4-bromophenyl)-8-methylimidazo[1,2-a]pyridine
CID 4715410
2-(4-bromophenyl)-8-methylimidazo[1,2-a]pyridine;hydrobromide
CID 67123054
6-bromo-3-methylchromen-2-one
CID 14956088
5-bromo-2-methoxy-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 121149779
6-chloro-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-oxochromene-3-carboxamide
CID 2971776
2-(8-methylimidazo[1,2-a]pyridin-2-yl)aniline
CID 117158401
6-bromo-3-(6-fluoroimidazo[2,1-b][1,3]benzothiazol-2-yl)chromen-2-one
CID 1119398
3-(1,3-benzothiazol-2-yl)-6-bromochromen-2-one
CID 1119428
7-(3,5-dimethylpiperazin-1-yl)-3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)chromen-2-one
CID 123206233

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
The IUPAC name of 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one (CID 1119394) is 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one.
What is the SMILES notation for 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
The canonical SMILES for 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one is Cc1cccn2cc(-c3cc4cc(Br)ccc4oc3=O)nc12.
What is the InChIKey of 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
The InChIKey is AEWDTCBLNYSLIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrN2O2/c1-10-3-2-6-20-9-14(19-16(10)20)13-8-11-7-12(18)4-5-15(11)22-17(13)21/h2-9H,1H3.
What are the key properties of 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one has a molecular weight of 355.19 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(8-methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one is sourced from PubChem (CID 1119394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).