4-amino-6-methoxyquinazoline-2-carboxylic acid

C10H9N3O3 — CID 105473523

IUPAC4-amino-6-methoxyquinazoline-2-carboxylic acid
SMILESCOc1ccc2nc(C(=O)O)nc(N)c2c1
InChIInChI=1S/C10H9N3O3/c1-16-5-2-3-7-6(4-5)8(11)13-9(12-7)10(14)15/h2-4H,1H3,(H,14,15)(H2,11,12,13)
InChIKeyBKXKNHUICDJHQO-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.92
Rot. Bonds2

About 4-amino-6-methoxyquinazoline-2-carboxylic acid

4-amino-6-methoxyquinazoline-2-carboxylic acid (PubChem CID 105473523) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is 4-amino-6-methoxyquinazoline-2-carboxylic acid.

Molecular Properties

Compound Name4-amino-6-methoxyquinazoline-2-carboxylic acid
PubChem CID105473523
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC Name4-amino-6-methoxyquinazoline-2-carboxylic acid
SMILESCOc1ccc2nc(C(=O)O)nc(N)c2c1
InChIInChI=1S/C10H9N3O3/c1-16-5-2-3-7-6(4-5)8(11)13-9(12-7)10(14)15/h2-4H,1H3,(H,14,15)(H2,11,12,13)
InChIKeyBKXKNHUICDJHQO-UHFFFAOYSA-N
XLogP0.92
TPSA98.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-6-methoxyquinazoline-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-amino-6-methoxyquinazolin-2-yl)ethanol
CID 105473832
2-(4-amino-6-methoxyquinazolin-2-yl)phenol
CID 137271406
2-[6-methoxy-2-(4-methylpiperazin-1-yl)quinazolin-4-yl]acetamide
CID 57481624
1-(6-methoxy-4-methylquinolin-2-yl)ethanone
CID 82576202
4-chloro-6-methoxycinnoline-3-carboxylic acid
CID 83898135
azane;6-methoxyquinoline-4-carboxylic acid
CID 67151937
2-(5-chloro-2-methylphenyl)-6-methoxyquinazolin-4-amine
CID 82875655
methyl 2-(6-methoxy-2-methylquinolin-4-yl)oxypropanoate
CID 53269444
2-(3-chlorothiophen-2-yl)-6-methoxyquinazolin-4-amine
CID 80641658
(E)-but-2-enedioic acid;6-methoxyquinolin-4-amine
CID 87801911
ethane;6-methoxy-2,4-dimethylquinoline
CID 143681558
sodium;hydride;6-methoxyquinoline-4-carboxylic acid
CID 173088597

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-methoxyquinazoline-2-carboxylic acid?
The IUPAC name of 4-amino-6-methoxyquinazoline-2-carboxylic acid (CID 105473523) is 4-amino-6-methoxyquinazoline-2-carboxylic acid.
What is the SMILES notation for 4-amino-6-methoxyquinazoline-2-carboxylic acid?
The canonical SMILES for 4-amino-6-methoxyquinazoline-2-carboxylic acid is COc1ccc2nc(C(=O)O)nc(N)c2c1.
What is the InChIKey of 4-amino-6-methoxyquinazoline-2-carboxylic acid?
The InChIKey is BKXKNHUICDJHQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c1-16-5-2-3-7-6(4-5)8(11)13-9(12-7)10(14)15/h2-4H,1H3,(H,14,15)(H2,11,12,13).
What are the key properties of 4-amino-6-methoxyquinazoline-2-carboxylic acid?
4-amino-6-methoxyquinazoline-2-carboxylic acid has a molecular weight of 219.20 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-methoxyquinazoline-2-carboxylic acid is sourced from PubChem (CID 105473523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).