2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one

C19H19N3O2 — CID 45258529

IUPAC2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one
SMILESCc1nc2ccccc2c(=O)n1-c1ccccc1N1CCOCC1
InChIInChI=1S/C19H19N3O2/c1-14-20-16-7-3-2-6-15(16)19(23)22(14)18-9-5-4-8-17(18)21-10-12-24-13-11-21/h2-9H,10-13H2,1H3
InChIKeyIEMYXTBEIVZIDY-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.53
Rot. Bonds2

About 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one

2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one (PubChem CID 45258529) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one.

Molecular Properties

Compound Name2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one
PubChem CID45258529
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one
SMILESCc1nc2ccccc2c(=O)n1-c1ccccc1N1CCOCC1
InChIInChI=1S/C19H19N3O2/c1-14-20-16-7-3-2-6-15(16)19(23)22(14)18-9-5-4-8-17(18)21-10-12-24-13-11-21/h2-9H,10-13H2,1H3
InChIKeyIEMYXTBEIVZIDY-UHFFFAOYSA-N
XLogP2.53
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

CID 131876705
CID 131876705
3-(4-hydroxy-2-methylphenyl)-2-methylquinazolin-4-one
CID 21143
3-(2-chloro-3-methylphenyl)-2-methylquinazolin-4-one
CID 3031678
2-methyl-3-(morpholin-4-ylmethylideneamino)quinazolin-4-one
CID 5125278
2-methyl-3-(2-methyl-3-trimethylsilyloxyphenyl)quinazolin-4-one
CID 629564
7-hydroxy-2-methyl-3-(2-methylphenyl)quinazolin-4-one
CID 5377276
2-methyl-3-[(E)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]quinazolin-4-one
CID 6908048
2-methyl-3-[2-(1,1,2,2,2-pentadeuterioethyl)phenyl]quinazolin-4-one
CID 71316434
3-(2,4-difluorophenyl)-2-methylquinazolin-4-one
CID 2824755
3-[2-(1H-benzimidazol-2-yl)phenyl]-2-methylquinazolin-4-one
CID 71327930
4-(2-methyl-4-oxoquinazolin-3-yl)-N-(2-piperidin-1-ylphenyl)benzamide
CID 43027483
2-(5-morpholin-4-yl-4-pyridin-4-ylthiophen-2-yl)-3-phenylquinazolin-4-one
CID 46885531

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one?
The IUPAC name of 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one (CID 45258529) is 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one.
What is the SMILES notation for 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one?
The canonical SMILES for 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one is Cc1nc2ccccc2c(=O)n1-c1ccccc1N1CCOCC1.
What is the InChIKey of 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one?
The InChIKey is IEMYXTBEIVZIDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-14-20-16-7-3-2-6-15(16)19(23)22(14)18-9-5-4-8-17(18)21-10-12-24-13-11-21/h2-9H,10-13H2,1H3.
What are the key properties of 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one?
2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one has a molecular weight of 321.38 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-morpholin-4-ylphenyl)quinazolin-4-one is sourced from PubChem (CID 45258529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).