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

C16H8Cl2N2O2 — CID 4277610

IUPAC3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one
SMILESO=c1oc2ccccc2cc1-c1cn2cc(Cl)cc(Cl)c2n1
InChIInChI=1S/C16H8Cl2N2O2/c17-10-6-12(18)15-19-13(8-20(15)7-10)11-5-9-3-1-2-4-14(9)22-16(11)21/h1-8H
InChIKeyCCYYGCZCWJLXCD-UHFFFAOYSA-N
MW331.16 g/mol
LogP4.41
Rot. Bonds1

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

3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one (PubChem CID 4277610) has the molecular formula C16H8Cl2N2O2 and a molecular weight of 331.16 g/mol. Its IUPAC name is 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one.

Molecular Properties

Compound Name3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one
PubChem CID4277610
Molecular FormulaC16H8Cl2N2O2
Molecular Weight331.16 g/mol
Exact Mass330.00
IUPAC Name3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one
SMILESO=c1oc2ccccc2cc1-c1cn2cc(Cl)cc(Cl)c2n1
InChIInChI=1S/C16H8Cl2N2O2/c17-10-6-12(18)15-19-13(8-20(15)7-10)11-5-9-3-1-2-4-14(9)22-16(11)21/h1-8H
InChIKeyCCYYGCZCWJLXCD-UHFFFAOYSA-N
XLogP4.41
TPSA47.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.16
LogP ≤ 54.41
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

(S)-3-(6,8-Dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(3-methylpiperazin-1-yl)-2H-chromen-2-one
CID 89655253
3-(8-Methyl-2-imidazo[1,2-a]pyridinyl)-1-benzopyran-2-one
CID 767302
3-(7-Methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
CID 830970
2-(6-chloro-2-(4-(2-fluoroethoxy)phenyl)imidazo(1,2-a)pyridin-3-yl)-N,N-diethylacetamide
CID 24895169
(18F)Pbr 111
CID 24944913
2-[6-chloro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
CID 168289645
3-(imidazo[1,2-a]pyridin-2-yl)-2H-chromen-2-one
CID 397075
3-Imidazo[1,2-a]pyrimidin-2-yl-chromen-2-one
CID 654596
8-methoxy-3-(8-methylimidazo[1,2-a]pyridin-2-yl)-2H-chromen-2-one
CID 767317
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-2-oxochromene-3-carboxamide
CID 2877674
Pbr-111
CID 24895171
3-(Imidazo[1,2-a]pyridin-2-yl)-7-(piperazin-1-yl)-2H-chromen-2-one
CID 71622408

Frequently Asked Questions

What is the IUPAC name of 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
The IUPAC name of 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one (CID 4277610) is 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one.
What is the SMILES notation for 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
The canonical SMILES for 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one is O=c1oc2ccccc2cc1-c1cn2cc(Cl)cc(Cl)c2n1.
What is the InChIKey of 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
The InChIKey is CCYYGCZCWJLXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8Cl2N2O2/c17-10-6-12(18)15-19-13(8-20(15)7-10)11-5-9-3-1-2-4-14(9)22-16(11)21/h1-8H.
What are the key properties of 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one?
3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one has a molecular weight of 331.16 g/mol, XLogP of 4.41, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)chromen-2-one is sourced from PubChem (CID 4277610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).