5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one

C19H17NO4 — CID 11688386

IUPAC5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(N3CCOCC3)cc(O)c12
InChIInChI=1S/C19H17NO4/c21-15-10-14(20-6-8-23-9-7-20)11-18-19(15)16(22)12-17(24-18)13-4-2-1-3-5-13/h1-5,10-12,21H,6-9H2
InChIKeyQLCYMYHLQRGYAZ-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.00
Rot. Bonds2

About 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one

5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one (PubChem CID 11688386) has the molecular formula C19H17NO4 and a molecular weight of 323.35 g/mol. Its IUPAC name is 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one.

Molecular Properties

Compound Name5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one
PubChem CID11688386
Molecular FormulaC19H17NO4
Molecular Weight323.35 g/mol
Exact Mass323.12
IUPAC Name5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one
SMILESO=c1cc(-c2ccccc2)oc2cc(N3CCOCC3)cc(O)c12
InChIInChI=1S/C19H17NO4/c21-15-10-14(20-6-8-23-9-7-20)11-18-19(15)16(22)12-17(24-18)13-4-2-1-3-5-13/h1-5,10-12,21H,6-9H2
InChIKeyQLCYMYHLQRGYAZ-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 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one?
The IUPAC name of 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one (CID 11688386) is 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one.
What is the SMILES notation for 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one?
The canonical SMILES for 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one is O=c1cc(-c2ccccc2)oc2cc(N3CCOCC3)cc(O)c12.
What is the InChIKey of 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one?
The InChIKey is QLCYMYHLQRGYAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4/c21-15-10-14(20-6-8-23-9-7-20)11-18-19(15)16(22)12-17(24-18)13-4-2-1-3-5-13/h1-5,10-12,21H,6-9H2.
What are the key properties of 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one?
5-hydroxy-7-morpholin-4-yl-2-phenylchromen-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 5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one is sourced from PubChem (CID 11688386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).