8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one

C20H20N2O4 — CID 15650862

IUPAC8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one
SMILESCc1c(OCc2cccnc2)ccc2c(=O)cc(N3CCOCC3)oc12
InChIInChI=1S/C20H20N2O4/c1-14-18(25-13-15-3-2-6-21-12-15)5-4-16-17(23)11-19(26-20(14)16)22-7-9-24-10-8-22/h2-6,11-12H,7-10,13H2,1H3
InChIKeyWBJPDBZCJJMXDF-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.91
Rot. Bonds4

About 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one

8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one (PubChem CID 15650862) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one.

Molecular Properties

Compound Name8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one
PubChem CID15650862
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one
SMILESCc1c(OCc2cccnc2)ccc2c(=O)cc(N3CCOCC3)oc12
InChIInChI=1S/C20H20N2O4/c1-14-18(25-13-15-3-2-6-21-12-15)5-4-16-17(23)11-19(26-20(14)16)22-7-9-24-10-8-22/h2-6,11-12H,7-10,13H2,1H3
InChIKeyWBJPDBZCJJMXDF-UHFFFAOYSA-N
XLogP2.91
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one?
The IUPAC name of 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one (CID 15650862) is 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one.
What is the SMILES notation for 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one?
The canonical SMILES for 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one is Cc1c(OCc2cccnc2)ccc2c(=O)cc(N3CCOCC3)oc12.
What is the InChIKey of 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one?
The InChIKey is WBJPDBZCJJMXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-14-18(25-13-15-3-2-6-21-12-15)5-4-16-17(23)11-19(26-20(14)16)22-7-9-24-10-8-22/h2-6,11-12H,7-10,13H2,1H3.
What are the key properties of 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one?
8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one has a molecular weight of 352.39 g/mol, XLogP of 2.91, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one is sourced from PubChem (CID 15650862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).