6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one

C20H19NO4 — CID 11522901

IUPAC6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one
SMILESCOc1ccc(-c2ccc3oc(N4CCOCC4)cc(=O)c3c2)cc1
InChIInChI=1S/C20H19NO4/c1-23-16-5-2-14(3-6-16)15-4-7-19-17(12-15)18(22)13-20(25-19)21-8-10-24-11-9-21/h2-7,12-13H,8-11H2,1H3
InChIKeyGZJBQNVAORIOHK-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.31
Rot. Bonds3

About 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one

6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one (PubChem CID 11522901) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one
PubChem CID11522901
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC Name6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one
SMILESCOc1ccc(-c2ccc3oc(N4CCOCC4)cc(=O)c3c2)cc1
InChIInChI=1S/C20H19NO4/c1-23-16-5-2-14(3-6-16)15-4-7-19-17(12-15)18(22)13-20(25-19)21-8-10-24-11-9-21/h2-7,12-13H,8-11H2,1H3
InChIKeyGZJBQNVAORIOHK-UHFFFAOYSA-N
XLogP3.31
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one?
The IUPAC name of 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one (CID 11522901) is 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one.
What is the SMILES notation for 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one?
The canonical SMILES for 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one is COc1ccc(-c2ccc3oc(N4CCOCC4)cc(=O)c3c2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one?
The InChIKey is GZJBQNVAORIOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-23-16-5-2-14(3-6-16)15-4-7-19-17(12-15)18(22)13-20(25-19)21-8-10-24-11-9-21/h2-7,12-13H,8-11H2,1H3.
What are the key properties of 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one?
6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one has a molecular weight of 337.38 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-2-morpholin-4-ylchromen-4-one is sourced from PubChem (CID 11522901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).