2-(4-amino-6-methoxyquinazolin-2-yl)phenol

C15H13N3O2 — CID 137271406

IUPAC2-(4-amino-6-methoxyquinazolin-2-yl)phenol
SMILESCOc1ccc2nc(-c3ccccc3O)nc(N)c2c1
InChIInChI=1S/C15H13N3O2/c1-20-9-6-7-12-11(8-9)14(16)18-15(17-12)10-4-2-3-5-13(10)19/h2-8,19H,1H3,(H2,16,17,18)
InChIKeyIZPXXZLJHBVGMT-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.59
Rot. Bonds2

About 2-(4-amino-6-methoxyquinazolin-2-yl)phenol

2-(4-amino-6-methoxyquinazolin-2-yl)phenol (PubChem CID 137271406) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(4-amino-6-methoxyquinazolin-2-yl)phenol.

Molecular Properties

Compound Name2-(4-amino-6-methoxyquinazolin-2-yl)phenol
PubChem CID137271406
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(4-amino-6-methoxyquinazolin-2-yl)phenol
SMILESCOc1ccc2nc(-c3ccccc3O)nc(N)c2c1
InChIInChI=1S/C15H13N3O2/c1-20-9-6-7-12-11(8-9)14(16)18-15(17-12)10-4-2-3-5-13(10)19/h2-8,19H,1H3,(H2,16,17,18)
InChIKeyIZPXXZLJHBVGMT-UHFFFAOYSA-N
XLogP2.59
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-methoxyquinazolin-2-yl)phenol?
The IUPAC name of 2-(4-amino-6-methoxyquinazolin-2-yl)phenol (CID 137271406) is 2-(4-amino-6-methoxyquinazolin-2-yl)phenol.
What is the SMILES notation for 2-(4-amino-6-methoxyquinazolin-2-yl)phenol?
The canonical SMILES for 2-(4-amino-6-methoxyquinazolin-2-yl)phenol is COc1ccc2nc(-c3ccccc3O)nc(N)c2c1.
What is the InChIKey of 2-(4-amino-6-methoxyquinazolin-2-yl)phenol?
The InChIKey is IZPXXZLJHBVGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-20-9-6-7-12-11(8-9)14(16)18-15(17-12)10-4-2-3-5-13(10)19/h2-8,19H,1H3,(H2,16,17,18).
What are the key properties of 2-(4-amino-6-methoxyquinazolin-2-yl)phenol?
2-(4-amino-6-methoxyquinazolin-2-yl)phenol has a molecular weight of 267.29 g/mol, XLogP of 2.59, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-methoxyquinazolin-2-yl)phenol is sourced from PubChem (CID 137271406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).