8-(methylamino)quinoline-6-carboxylic acid

C11H10N2O2 — CID 170992656

IUPAC8-(methylamino)quinoline-6-carboxylic acid
SMILESCNc1cc(C(=O)O)cc2cccnc12
InChIInChI=1S/C11H10N2O2/c1-12-9-6-8(11(14)15)5-7-3-2-4-13-10(7)9/h2-6,12H,1H3,(H,14,15)
InChIKeyAJNZSRVPHSOAFA-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.97
Rot. Bonds2

About 8-(methylamino)quinoline-6-carboxylic acid

8-(methylamino)quinoline-6-carboxylic acid (PubChem CID 170992656) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 8-(methylamino)quinoline-6-carboxylic acid.

Molecular Properties

Compound Name8-(methylamino)quinoline-6-carboxylic acid
PubChem CID170992656
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name8-(methylamino)quinoline-6-carboxylic acid
SMILESCNc1cc(C(=O)O)cc2cccnc12
InChIInChI=1S/C11H10N2O2/c1-12-9-6-8(11(14)15)5-7-3-2-4-13-10(7)9/h2-6,12H,1H3,(H,14,15)
InChIKeyAJNZSRVPHSOAFA-UHFFFAOYSA-N
XLogP1.97
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-(2-methoxypropylsulfonylamino)quinoline-6-carboxylic acid
CID 167792756
8-sulfamoylquinoline-6-carboxylic acid
CID 50989782
8-pyridin-3-ylquinoline-6-carboxylic acid
CID 156718043
3-(methylamino)pyridine-2-carboxylic acid
CID 19779285
8-[(1-cyclobutylpyrazol-3-yl)methylamino]quinoline-6-carboxylic acid
CID 166275206
8-(6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-ylmethylamino)quinoline-6-carboxylic acid
CID 166267732
8-(2-chloropropanoylamino)quinoline-6-carboxamide
CID 146098722
ethane;quinoline-6-carboxylic acid
CID 91364452
5-(quinolin-8-ylamino)pyridine-3-carboxylic acid
CID 82535032
methyl 8-(cyclopropylcarbamoylamino)quinoline-6-carboxylate
CID 170992823
tris(benzene-1,2,4,5-tetracarboxylic acid);tetrakis(1,10-phenanthroline)
CID 71445169
N-(6-methoxyquinolin-8-yl)benzamide
CID 684962

Frequently Asked Questions

What is the IUPAC name of 8-(methylamino)quinoline-6-carboxylic acid?
The IUPAC name of 8-(methylamino)quinoline-6-carboxylic acid (CID 170992656) is 8-(methylamino)quinoline-6-carboxylic acid.
What is the SMILES notation for 8-(methylamino)quinoline-6-carboxylic acid?
The canonical SMILES for 8-(methylamino)quinoline-6-carboxylic acid is CNc1cc(C(=O)O)cc2cccnc12.
What is the InChIKey of 8-(methylamino)quinoline-6-carboxylic acid?
The InChIKey is AJNZSRVPHSOAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-12-9-6-8(11(14)15)5-7-3-2-4-13-10(7)9/h2-6,12H,1H3,(H,14,15).
What are the key properties of 8-(methylamino)quinoline-6-carboxylic acid?
8-(methylamino)quinoline-6-carboxylic acid has a molecular weight of 202.21 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(methylamino)quinoline-6-carboxylic acid is sourced from PubChem (CID 170992656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).