8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one

C19H17NO4 — CID 11609490

IUPAC8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3cccc(O)c3)cccc12
InChIInChI=1S/C19H17NO4/c21-14-4-1-3-13(11-14)15-5-2-6-16-17(22)12-18(24-19(15)16)20-7-9-23-10-8-20/h1-6,11-12,21H,7-10H2
InChIKeyWPUKKEMHTVGTFK-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.00
Rot. Bonds2

About 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one

8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one (PubChem CID 11609490) has the molecular formula C19H17NO4 and a molecular weight of 323.35 g/mol. Its IUPAC name is 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one.

Molecular Properties

Compound Name8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one
PubChem CID11609490
Molecular FormulaC19H17NO4
Molecular Weight323.35 g/mol
Exact Mass323.12
IUPAC Name8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3cccc(O)c3)cccc12
InChIInChI=1S/C19H17NO4/c21-14-4-1-3-13(11-14)15-5-2-6-16-17(22)12-18(24-19(15)16)20-7-9-23-10-8-20/h1-6,11-12,21H,7-10H2
InChIKeyWPUKKEMHTVGTFK-UHFFFAOYSA-N
XLogP3.00
TPSA62.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one?
The IUPAC name of 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one (CID 11609490) is 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one.
What is the SMILES notation for 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one?
The canonical SMILES for 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one is O=c1cc(N2CCOCC2)oc2c(-c3cccc(O)c3)cccc12.
What is the InChIKey of 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one?
The InChIKey is WPUKKEMHTVGTFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4/c21-14-4-1-3-13(11-14)15-5-2-6-16-17(22)12-18(24-19(15)16)20-7-9-23-10-8-20/h1-6,11-12,21H,7-10H2.
What are the key properties of 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one?
8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one has a molecular weight of 323.35 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one is sourced from PubChem (CID 11609490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).