3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one

C19H19N3O2 — CID 167886236

IUPAC3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one
SMILESCn1cnc2cc(-c3cccc(N4CCOCC4)c3)ccc2c1=O
InChIInChI=1S/C19H19N3O2/c1-21-13-20-18-12-15(5-6-17(18)19(21)23)14-3-2-4-16(11-14)22-7-9-24-10-8-22/h2-6,11-13H,7-10H2,1H3
InChIKeyYAGKTZGBYVFWLB-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.44
Rot. Bonds2

About 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one

3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one (PubChem CID 167886236) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one.

Molecular Properties

Compound Name3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one
PubChem CID167886236
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one
SMILESCn1cnc2cc(-c3cccc(N4CCOCC4)c3)ccc2c1=O
InChIInChI=1S/C19H19N3O2/c1-21-13-20-18-12-15(5-6-17(18)19(21)23)14-3-2-4-16(11-14)22-7-9-24-10-8-22/h2-6,11-13H,7-10H2,1H3
InChIKeyYAGKTZGBYVFWLB-UHFFFAOYSA-N
XLogP2.44
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 ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]-3-methylquinazolin-4-one
CID 126896886
3-methyl-5-(methylamino)-7-(4-morpholin-4-ylphenyl)pyrido[4,3-d]pyrimidin-4-one
CID 123985024
7-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-3-propan-2-ylquinazolin-4-one
CID 126897342
3-methyl-7-(4-pyrimidin-4-ylpiperazin-1-yl)quinazolin-4-one
CID 126897138
5-ethyl-7-(3-morpholin-4-ylphenyl)-1H-pyrazolo[4,5-c]quinolin-4-one
CID 71539753
3-methyl-7-[3-[(3S)-oxolan-3-yl]-1,2,4-oxadiazol-5-yl]quinazolin-4-one
CID 97443977
5-(2-hydroxyethoxy)-3-methyl-7-(4-morpholin-4-ylphenyl)pyrido[4,3-d]pyrimidin-4-one
CID 66959821
3-methyl-7-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]quinazolin-4-one
CID 126897077
3-methyl-7-[4-(1,3-oxazol-2-ylmethyl)piperazin-1-yl]quinazolin-4-one
CID 126896977
3-methyl-2-[4-(3-methyl-4-oxoquinazolin-7-yl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-4-one
CID 126897211
3-methyl-7-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]quinazolin-4-one
CID 126896954
7-[4-(3-chloro-4-pyridinyl)piperazin-1-yl]-3-methylquinazolin-4-one
CID 126896880

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one?
The IUPAC name of 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one (CID 167886236) is 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one.
What is the SMILES notation for 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one?
The canonical SMILES for 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one is Cn1cnc2cc(-c3cccc(N4CCOCC4)c3)ccc2c1=O.
What is the InChIKey of 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one?
The InChIKey is YAGKTZGBYVFWLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-21-13-20-18-12-15(5-6-17(18)19(21)23)14-3-2-4-16(11-14)22-7-9-24-10-8-22/h2-6,11-13H,7-10H2,1H3.
What are the key properties of 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one?
3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one has a molecular weight of 321.38 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-(3-morpholin-4-ylphenyl)quinazolin-4-one is sourced from PubChem (CID 167886236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).