2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline

C23H20N2 — CID 140676068

IUPAC2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline
SMILESCC(C)(c1ccccc1)c1cccc(-c2ncc3ccccc3n2)c1
InChIInChI=1S/C23H20N2/c1-23(2,19-11-4-3-5-12-19)20-13-8-10-17(15-20)22-24-16-18-9-6-7-14-21(18)25-22/h3-16H,1-2H3
InChIKeyFSBYLPQCANRQQI-UHFFFAOYSA-N
MW324.43 g/mol
LogP5.62
Rot. Bonds3

About 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline

2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline (PubChem CID 140676068) has the molecular formula C23H20N2 and a molecular weight of 324.43 g/mol. Its IUPAC name is 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline.

Molecular Properties

Compound Name2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline
PubChem CID140676068
Molecular FormulaC23H20N2
Molecular Weight324.43 g/mol
Exact Mass324.16
IUPAC Name2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline
SMILESCC(C)(c1ccccc1)c1cccc(-c2ncc3ccccc3n2)c1
InChIInChI=1S/C23H20N2/c1-23(2,19-11-4-3-5-12-19)20-13-8-10-17(15-20)22-24-16-18-9-6-7-14-21(18)25-22/h3-16H,1-2H3
InChIKeyFSBYLPQCANRQQI-UHFFFAOYSA-N
XLogP5.62
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.43
LogP ≤ 55.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline 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 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline?
The IUPAC name of 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline (CID 140676068) is 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline.
What is the SMILES notation for 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline?
The canonical SMILES for 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline is CC(C)(c1ccccc1)c1cccc(-c2ncc3ccccc3n2)c1.
What is the InChIKey of 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline?
The InChIKey is FSBYLPQCANRQQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2/c1-23(2,19-11-4-3-5-12-19)20-13-8-10-17(15-20)22-24-16-18-9-6-7-14-21(18)25-22/h3-16H,1-2H3.
What are the key properties of 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline?
2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline has a molecular weight of 324.43 g/mol, XLogP of 5.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-phenylpropan-2-yl)phenyl]quinazoline is sourced from PubChem (CID 140676068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).