6-quinolin-3-ylquinazoline

C17H11N3 — CID 155521099

IUPAC6-quinolin-3-ylquinazoline
SMILESc1ccc2ncc(-c3ccc4ncncc4c3)cc2c1
InChIInChI=1S/C17H11N3/c1-2-4-16-13(3-1)8-14(10-19-16)12-5-6-17-15(7-12)9-18-11-20-17/h1-11H
InChIKeyBCDKNQLNLXQSJE-UHFFFAOYSA-N
MW257.30 g/mol
LogP3.85
Rot. Bonds1

About 6-quinolin-3-ylquinazoline

6-quinolin-3-ylquinazoline (PubChem CID 155521099) has the molecular formula C17H11N3 and a molecular weight of 257.30 g/mol. Its IUPAC name is 6-quinolin-3-ylquinazoline.

Molecular Properties

Compound Name6-quinolin-3-ylquinazoline
PubChem CID155521099
Molecular FormulaC17H11N3
Molecular Weight257.30 g/mol
Exact Mass257.10
IUPAC Name6-quinolin-3-ylquinazoline
SMILESc1ccc2ncc(-c3ccc4ncncc4c3)cc2c1
InChIInChI=1S/C17H11N3/c1-2-4-16-13(3-1)8-14(10-19-16)12-5-6-17-15(7-12)9-18-11-20-17/h1-11H
InChIKeyBCDKNQLNLXQSJE-UHFFFAOYSA-N
XLogP3.85
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-quinolin-3-ylquinazoline?
The IUPAC name of 6-quinolin-3-ylquinazoline (CID 155521099) is 6-quinolin-3-ylquinazoline.
What is the SMILES notation for 6-quinolin-3-ylquinazoline?
The canonical SMILES for 6-quinolin-3-ylquinazoline is c1ccc2ncc(-c3ccc4ncncc4c3)cc2c1.
What is the InChIKey of 6-quinolin-3-ylquinazoline?
The InChIKey is BCDKNQLNLXQSJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3/c1-2-4-16-13(3-1)8-14(10-19-16)12-5-6-17-15(7-12)9-18-11-20-17/h1-11H.
What are the key properties of 6-quinolin-3-ylquinazoline?
6-quinolin-3-ylquinazoline has a molecular weight of 257.30 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-quinolin-3-ylquinazoline is sourced from PubChem (CID 155521099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).