7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one

C21H20N2O3 — CID 112787885

IUPAC7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one
SMILESCCCc1cc(=O)oc2cc(OCc3cn4cc(C)ccc4n3)ccc12
InChIInChI=1S/C21H20N2O3/c1-3-4-15-9-21(24)26-19-10-17(6-7-18(15)19)25-13-16-12-23-11-14(2)5-8-20(23)22-16/h5-12H,3-4,13H2,1-2H3
InChIKeyQGGSTBGWUIHCTH-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.28
Rot. Bonds5

About 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one

7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one (PubChem CID 112787885) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one.

Molecular Properties

Compound Name7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one
PubChem CID112787885
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC Name7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one
SMILESCCCc1cc(=O)oc2cc(OCc3cn4cc(C)ccc4n3)ccc12
InChIInChI=1S/C21H20N2O3/c1-3-4-15-9-21(24)26-19-10-17(6-7-18(15)19)25-13-16-12-23-11-14(2)5-8-20(23)22-16/h5-12H,3-4,13H2,1-2H3
InChIKeyQGGSTBGWUIHCTH-UHFFFAOYSA-N
XLogP4.28
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-methyl-2-[(2-oxo-4-propylchromen-7-yl)oxymethyl]pyrido[1,2-a]pyrimidin-4-one
CID 51293952
7-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-4-propylchromen-2-one
CID 7917685
7-(naphthalen-1-ylmethoxy)-4-propylchromen-2-one
CID 7917681
7-[(2-methylnaphthalen-1-yl)methoxy]-4-propylchromen-2-one
CID 23763929
4-propyl-7-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methoxy]chromen-2-one
CID 46933173
7-[(4-bromophenyl)methoxy]-4-propylchromen-2-one
CID 22310572
4-propyl-7-[(3,4,5-trimethoxyphenyl)methoxy]chromen-2-one
CID 1325534
(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 2-(4-methyl-2-oxochromen-7-yl)oxyacetate
CID 8858505
7-(6-chloro-2-methylpyrimidin-4-yl)oxy-4-propylchromen-2-one
CID 133280797
7-[(2-chloro-4-fluorophenyl)methoxy]-4-propylchromen-2-one
CID 886164
7-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methoxy]-4-propylchromen-2-one
CID 46583293
7-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-4-propylchromen-2-one
CID 9353949

Frequently Asked Questions

What is the IUPAC name of 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one?
The IUPAC name of 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one (CID 112787885) is 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one.
What is the SMILES notation for 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one?
The canonical SMILES for 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one is CCCc1cc(=O)oc2cc(OCc3cn4cc(C)ccc4n3)ccc12.
What is the InChIKey of 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one?
The InChIKey is QGGSTBGWUIHCTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-3-4-15-9-21(24)26-19-10-17(6-7-18(15)19)25-13-16-12-23-11-14(2)5-8-20(23)22-16/h5-12H,3-4,13H2,1-2H3.
What are the key properties of 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one?
7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one has a molecular weight of 348.40 g/mol, XLogP of 4.28, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-4-propylchromen-2-one is sourced from PubChem (CID 112787885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).