4-methylquinoline-8-carboxylic acid

C11H9NO2 — CID 12597844

IUPAC4-methylquinoline-8-carboxylic acid
SMILESCc1ccnc2c(C(=O)O)cccc12
InChIInChI=1S/C11H9NO2/c1-7-5-6-12-10-8(7)3-2-4-9(10)11(13)14/h2-6H,1H3,(H,13,14)
InChIKeyQXIYMAYIEOSSJE-UHFFFAOYSA-N
MW187.20 g/mol
LogP2.24
Rot. Bonds1

About 4-methylquinoline-8-carboxylic acid

4-methylquinoline-8-carboxylic acid (PubChem CID 12597844) has the molecular formula C11H9NO2 and a molecular weight of 187.20 g/mol. Its IUPAC name is 4-methylquinoline-8-carboxylic acid.

Molecular Properties

Compound Name4-methylquinoline-8-carboxylic acid
PubChem CID12597844
Molecular FormulaC11H9NO2
Molecular Weight187.20 g/mol
Exact Mass187.06
IUPAC Name4-methylquinoline-8-carboxylic acid
SMILESCc1ccnc2c(C(=O)O)cccc12
InChIInChI=1S/C11H9NO2/c1-7-5-6-12-10-8(7)3-2-4-9(10)11(13)14/h2-6H,1H3,(H,13,14)
InChIKeyQXIYMAYIEOSSJE-UHFFFAOYSA-N
XLogP2.24
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

aluminum tris(4-methylquinoline-8-carboxylate)
CID 23160254
4-bromoquinoline-8-carboxylic acid
CID 71742974
2-(4-methylquinolin-8-yl)oxypropanoic acid
CID 82580360
palladium;quinoline-8-carboxylic acid
CID 174945118
1-(4-methylquinolin-8-yl)ethanol
CID 82575957
4-(methylamino)quinazoline-8-carboxylic acid
CID 71208033
2-methylpyridine-3-carboxylic acid;hydroiodide
CID 70394156
1-propan-2-ylisoquinoline-5-carboxylic acid
CID 178019104
CID 175079027
CID 175079027
carbonic acid;2-methoxy-3-methylbenzoic acid
CID 69114521
4-(4-methylquinolin-8-yl)phenol
CID 70813366
1-methoxyisoquinoline-5-carboxylic acid
CID 82569725

Frequently Asked Questions

What is the IUPAC name of 4-methylquinoline-8-carboxylic acid?
The IUPAC name of 4-methylquinoline-8-carboxylic acid (CID 12597844) is 4-methylquinoline-8-carboxylic acid.
What is the SMILES notation for 4-methylquinoline-8-carboxylic acid?
The canonical SMILES for 4-methylquinoline-8-carboxylic acid is Cc1ccnc2c(C(=O)O)cccc12.
What is the InChIKey of 4-methylquinoline-8-carboxylic acid?
The InChIKey is QXIYMAYIEOSSJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO2/c1-7-5-6-12-10-8(7)3-2-4-9(10)11(13)14/h2-6H,1H3,(H,13,14).
What are the key properties of 4-methylquinoline-8-carboxylic acid?
4-methylquinoline-8-carboxylic acid has a molecular weight of 187.20 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylquinoline-8-carboxylic acid is sourced from PubChem (CID 12597844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).