2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one

C24H20N2O3 — CID 44562531

IUPAC2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3cccc(-c4ccccn4)c3)cccc12
InChIInChI=1S/C24H20N2O3/c27-22-16-23(26-11-13-28-14-12-26)29-24-19(7-4-8-20(22)24)17-5-3-6-18(15-17)21-9-1-2-10-25-21/h1-10,15-16H,11-14H2
InChIKeyRZXHAHWHWMPFDL-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.36
Rot. Bonds3

About 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one

2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one (PubChem CID 44562531) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one.

Molecular Properties

Compound Name2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one
PubChem CID44562531
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3cccc(-c4ccccn4)c3)cccc12
InChIInChI=1S/C24H20N2O3/c27-22-16-23(26-11-13-28-14-12-26)29-24-19(7-4-8-20(22)24)17-5-3-6-18(15-17)21-9-1-2-10-25-21/h1-10,15-16H,11-14H2
InChIKeyRZXHAHWHWMPFDL-UHFFFAOYSA-N
XLogP4.36
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one?
The IUPAC name of 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one (CID 44562531) is 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one.
What is the SMILES notation for 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one?
The canonical SMILES for 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one is O=c1cc(N2CCOCC2)oc2c(-c3cccc(-c4ccccn4)c3)cccc12.
What is the InChIKey of 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one?
The InChIKey is RZXHAHWHWMPFDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c27-22-16-23(26-11-13-28-14-12-26)29-24-19(7-4-8-20(22)24)17-5-3-6-18(15-17)21-9-1-2-10-25-21/h1-10,15-16H,11-14H2.
What are the key properties of 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one?
2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one has a molecular weight of 384.44 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-8-(3-pyridin-2-ylphenyl)chromen-4-one is sourced from PubChem (CID 44562531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).