4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine

C21H23N3O3 — CID 24855181

IUPAC4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine
SMILESCOc1cc2ncnc(N3CCOC(c4ccc(C)cc4)C3)c2cc1OC
InChIInChI=1S/C21H23N3O3/c1-14-4-6-15(7-5-14)20-12-24(8-9-27-20)21-16-10-18(25-2)19(26-3)11-17(16)22-13-23-21/h4-7,10-11,13,20H,8-9,12H2,1-3H3
InChIKeyMKZPZJHRWMNYJL-UHFFFAOYSA-N
MW365.43 g/mol
LogP3.53
Rot. Bonds4

About 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine

4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine (PubChem CID 24855181) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine.

Molecular Properties

Compound Name4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine
PubChem CID24855181
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Name4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine
SMILESCOc1cc2ncnc(N3CCOC(c4ccc(C)cc4)C3)c2cc1OC
InChIInChI=1S/C21H23N3O3/c1-14-4-6-15(7-5-14)20-12-24(8-9-27-20)21-16-10-18(25-2)19(26-3)11-17(16)22-13-23-21/h4-7,10-11,13,20H,8-9,12H2,1-3H3
InChIKeyMKZPZJHRWMNYJL-UHFFFAOYSA-N
XLogP3.53
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine?
The IUPAC name of 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine (CID 24855181) is 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine.
What is the SMILES notation for 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine?
The canonical SMILES for 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine is COc1cc2ncnc(N3CCOC(c4ccc(C)cc4)C3)c2cc1OC.
What is the InChIKey of 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine?
The InChIKey is MKZPZJHRWMNYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-14-4-6-15(7-5-14)20-12-24(8-9-27-20)21-16-10-18(25-2)19(26-3)11-17(16)22-13-23-21/h4-7,10-11,13,20H,8-9,12H2,1-3H3.
What are the key properties of 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine?
4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine has a molecular weight of 365.43 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,7-dimethoxyquinazolin-4-yl)-2-(4-methylphenyl)morpholine is sourced from PubChem (CID 24855181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).