8-methylquinazoline-4-carboxylic acid

C10H8N2O2 — CID 124706584

IUPAC8-methylquinazoline-4-carboxylic acid
SMILESCc1cccc2c(C(=O)O)ncnc12
InChIInChI=1S/C10H8N2O2/c1-6-3-2-4-7-8(6)11-5-12-9(7)10(13)14/h2-5H,1H3,(H,13,14)
InChIKeyQKKMKUYIIHIVBP-UHFFFAOYSA-N
MW188.19 g/mol
LogP1.64
Rot. Bonds1

About 8-methylquinazoline-4-carboxylic acid

8-methylquinazoline-4-carboxylic acid (PubChem CID 124706584) has the molecular formula C10H8N2O2 and a molecular weight of 188.19 g/mol. Its IUPAC name is 8-methylquinazoline-4-carboxylic acid.

Molecular Properties

Compound Name8-methylquinazoline-4-carboxylic acid
PubChem CID124706584
Molecular FormulaC10H8N2O2
Molecular Weight188.19 g/mol
Exact Mass188.06
IUPAC Name8-methylquinazoline-4-carboxylic acid
SMILESCc1cccc2c(C(=O)O)ncnc12
InChIInChI=1S/C10H8N2O2/c1-6-3-2-4-7-8(6)11-5-12-9(7)10(13)14/h2-5H,1H3,(H,13,14)
InChIKeyQKKMKUYIIHIVBP-UHFFFAOYSA-N
XLogP1.64
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-methylquinazoline-4-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

8-methoxyquinazoline-4-carboxylic acid
CID 105455920
8-chloroquinazoline-4-carboxylic acid
CID 105462454
4-chloro-8-methylquinoline-2,3-dicarboxylic acid
CID 141332367
5-amino-4-methylisoquinoline-1-carboxylic acid
CID 82571670
3,5-dimethylisoquinoline-1-carboxylic acid
CID 84670077
N-ethyl-4-(8-methylquinazolin-4-yl)piperazine-1-carboxamide
CID 133387176
2-(4-chloro-8-methylquinolin-3-yl)acetic acid
CID 84699093
4,5-dimethylacridine-9-carboxylate
CID 7095758
2-(2,8-dimethylquinolin-4-yl)acetic acid
CID 82447836
3-methylpyridine-2-carboxylic acid;oxygen(2-);vanadium(4+)
CID 10058713
ethyl 3-[methyl-(8-methylquinazolin-4-yl)amino]butanoate
CID 133465027
2-[(8-methylquinazolin-4-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 133388467

Frequently Asked Questions

What is the IUPAC name of 8-methylquinazoline-4-carboxylic acid?
The IUPAC name of 8-methylquinazoline-4-carboxylic acid (CID 124706584) is 8-methylquinazoline-4-carboxylic acid.
What is the SMILES notation for 8-methylquinazoline-4-carboxylic acid?
The canonical SMILES for 8-methylquinazoline-4-carboxylic acid is Cc1cccc2c(C(=O)O)ncnc12.
What is the InChIKey of 8-methylquinazoline-4-carboxylic acid?
The InChIKey is QKKMKUYIIHIVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2/c1-6-3-2-4-7-8(6)11-5-12-9(7)10(13)14/h2-5H,1H3,(H,13,14).
What are the key properties of 8-methylquinazoline-4-carboxylic acid?
8-methylquinazoline-4-carboxylic acid has a molecular weight of 188.19 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylquinazoline-4-carboxylic acid is sourced from PubChem (CID 124706584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).