8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one

C13H13N3O4 — CID 136608339

IUPAC8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one
SMILESO=C(c1cc(O)c2nc[nH]c(=O)c2c1)N1CCOCC1
InChIInChI=1S/C13H13N3O4/c17-10-6-8(13(19)16-1-3-20-4-2-16)5-9-11(10)14-7-15-12(9)18/h5-7,17H,1-4H2,(H,14,15,18)
InChIKeyDKHMGTJBJDFXGQ-UHFFFAOYSA-N
MW275.26 g/mol
LogP0.10
Rot. Bonds1

About 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one

8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one (PubChem CID 136608339) has the molecular formula C13H13N3O4 and a molecular weight of 275.26 g/mol. Its IUPAC name is 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one.

Molecular Properties

Compound Name8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one
PubChem CID136608339
Molecular FormulaC13H13N3O4
Molecular Weight275.26 g/mol
Exact Mass275.09
IUPAC Name8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one
SMILESO=C(c1cc(O)c2nc[nH]c(=O)c2c1)N1CCOCC1
InChIInChI=1S/C13H13N3O4/c17-10-6-8(13(19)16-1-3-20-4-2-16)5-9-11(10)14-7-15-12(9)18/h5-7,17H,1-4H2,(H,14,15,18)
InChIKeyDKHMGTJBJDFXGQ-UHFFFAOYSA-N
XLogP0.10
TPSA95.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.26
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

morpholin-4-yl-(3,4,5-trihydroxyphenyl)methanone
CID 3047894
[4-(morpholine-4-carbonyl)-1H-imidazol-5-yl]-morpholin-4-ylmethanone
CID 4736510
[2-[4-(morpholine-4-carbonyl)-2-pyridinyl]-4-pyridinyl]-morpholin-4-ylmethanone
CID 171623322
8-hydroxy-6-[3-methyl-5-(4-methylpiperazine-1-carbonyl)thiophen-2-yl]-3H-quinazolin-4-one
CID 135567268
[2,3-diacetyloxy-5-(morpholine-4-carbonyl)phenyl] acetate
CID 12509978
2,6-difluoro-4-(morpholine-4-carbonyl)benzamide
CID 68557409
6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 36708442
2-hydroxy-5-(morpholine-4-carbonyl)benzoic acid
CID 123499675
[3-(4-hydroxyphenyl)phenyl]-morpholin-4-ylmethanone
CID 2428040
8-bromo-6-(morpholine-4-carbonyl)-2-morpholin-4-ylchromen-4-one
CID 86672414
8-hydroxy-6-(2-oxo-1H-pyridin-3-yl)-3H-quinazolin-4-one
CID 136608410
morpholin-4-yl(pyridazin-4-yl)methanone
CID 115736040

Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one?
The IUPAC name of 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one (CID 136608339) is 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one.
What is the SMILES notation for 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one?
The canonical SMILES for 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one is O=C(c1cc(O)c2nc[nH]c(=O)c2c1)N1CCOCC1.
What is the InChIKey of 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one?
The InChIKey is DKHMGTJBJDFXGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O4/c17-10-6-8(13(19)16-1-3-20-4-2-16)5-9-11(10)14-7-15-12(9)18/h5-7,17H,1-4H2,(H,14,15,18).
What are the key properties of 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one?
8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one has a molecular weight of 275.26 g/mol, XLogP of 0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-6-(morpholine-4-carbonyl)-3H-quinazolin-4-one is sourced from PubChem (CID 136608339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).