2-aminoquinazolin-7-ol

C8H7N3O — CID 141030840

IUPAC2-aminoquinazolin-7-ol
SMILESNc1ncc2ccc(O)cc2n1
InChIInChI=1S/C8H7N3O/c9-8-10-4-5-1-2-6(12)3-7(5)11-8/h1-4,12H,(H2,9,10,11)
InChIKeyRCJMMHZGCHOIKH-UHFFFAOYSA-N
MW161.16 g/mol
LogP0.92
Rot. Bonds

About 2-aminoquinazolin-7-ol

2-aminoquinazolin-7-ol (PubChem CID 141030840) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 2-aminoquinazolin-7-ol.

Molecular Properties

Compound Name2-aminoquinazolin-7-ol
PubChem CID141030840
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name2-aminoquinazolin-7-ol
SMILESNc1ncc2ccc(O)cc2n1
InChIInChI=1S/C8H7N3O/c9-8-10-4-5-1-2-6(12)3-7(5)11-8/h1-4,12H,(H2,9,10,11)
InChIKeyRCJMMHZGCHOIKH-UHFFFAOYSA-N
XLogP0.92
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-aminoquinazolin-7-ol?
The IUPAC name of 2-aminoquinazolin-7-ol (CID 141030840) is 2-aminoquinazolin-7-ol.
What is the SMILES notation for 2-aminoquinazolin-7-ol?
The canonical SMILES for 2-aminoquinazolin-7-ol is Nc1ncc2ccc(O)cc2n1.
What is the InChIKey of 2-aminoquinazolin-7-ol?
The InChIKey is RCJMMHZGCHOIKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c9-8-10-4-5-1-2-6(12)3-7(5)11-8/h1-4,12H,(H2,9,10,11).
What are the key properties of 2-aminoquinazolin-7-ol?
2-aminoquinazolin-7-ol has a molecular weight of 161.16 g/mol, XLogP of 0.92, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoquinazolin-7-ol is sourced from PubChem (CID 141030840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).