2-(2,2-diphenylethyl)-6-methoxyquinazoline

C23H20N2O — CID 154407491

IUPAC2-(2,2-diphenylethyl)-6-methoxyquinazoline
SMILESCOc1ccc2nc(CC(c3ccccc3)c3ccccc3)ncc2c1
InChIInChI=1S/C23H20N2O/c1-26-20-12-13-22-19(14-20)16-24-23(25-22)15-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,16,21H,15H2,1H3
InChIKeyMLJKYBCSGAGFAG-UHFFFAOYSA-N
MW340.43 g/mol
LogP5.01
Rot. Bonds5

About 2-(2,2-diphenylethyl)-6-methoxyquinazoline

2-(2,2-diphenylethyl)-6-methoxyquinazoline (PubChem CID 154407491) has the molecular formula C23H20N2O and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-(2,2-diphenylethyl)-6-methoxyquinazoline.

Molecular Properties

Compound Name2-(2,2-diphenylethyl)-6-methoxyquinazoline
PubChem CID154407491
Molecular FormulaC23H20N2O
Molecular Weight340.43 g/mol
Exact Mass340.16
IUPAC Name2-(2,2-diphenylethyl)-6-methoxyquinazoline
SMILESCOc1ccc2nc(CC(c3ccccc3)c3ccccc3)ncc2c1
InChIInChI=1S/C23H20N2O/c1-26-20-12-13-22-19(14-20)16-24-23(25-22)15-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,16,21H,15H2,1H3
InChIKeyMLJKYBCSGAGFAG-UHFFFAOYSA-N
XLogP5.01
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.43
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-methoxyquinazolin-2-yl)-N-methylethanamine
CID 105471328
N-[(6-methoxyquinazolin-2-yl)methyl]propan-1-amine
CID 146331836
6-methoxy-2-methylquinazoline
CID 54578216
(1S)-1-(6-methoxyquinolin-2-yl)-2-phenylethanamine
CID 146479702
(6-methoxyquinolin-3-yl)-phenylmethanone
CID 102416724
2-methoxy-7-[(2R)-1-phenylpropan-2-yl]oxyphenazine
CID 155707776
1-methoxy-4-[(2R)-2-phenylpropyl]benzene
CID 69111235
N-butyl-6-methoxyquinazolin-2-amine
CID 141287869
3-(bromomethyl)-6-methoxy-2-phenylquinoline
CID 67199058
2-amino-2-(6-methoxyquinazolin-2-yl)propan-1-ol
CID 68603521
1-(7-methoxyquinazolin-2-yl)-N-methylmethanamine
CID 105455359
6-methoxy-3-phenylisoquinoline
CID 68806176

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-diphenylethyl)-6-methoxyquinazoline?
The IUPAC name of 2-(2,2-diphenylethyl)-6-methoxyquinazoline (CID 154407491) is 2-(2,2-diphenylethyl)-6-methoxyquinazoline.
What is the SMILES notation for 2-(2,2-diphenylethyl)-6-methoxyquinazoline?
The canonical SMILES for 2-(2,2-diphenylethyl)-6-methoxyquinazoline is COc1ccc2nc(CC(c3ccccc3)c3ccccc3)ncc2c1.
What is the InChIKey of 2-(2,2-diphenylethyl)-6-methoxyquinazoline?
The InChIKey is MLJKYBCSGAGFAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O/c1-26-20-12-13-22-19(14-20)16-24-23(25-22)15-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,16,21H,15H2,1H3.
What are the key properties of 2-(2,2-diphenylethyl)-6-methoxyquinazoline?
2-(2,2-diphenylethyl)-6-methoxyquinazoline has a molecular weight of 340.43 g/mol, XLogP of 5.01, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-diphenylethyl)-6-methoxyquinazoline is sourced from PubChem (CID 154407491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).