7-methoxy-2-(propylamino)quinoline-3-carboxylic acid

C14H16N2O3 — CID 10400374

IUPAC7-methoxy-2-(propylamino)quinoline-3-carboxylic acid
SMILESCCCNc1nc2cc(OC)ccc2cc1C(=O)O
InChIInChI=1S/C14H16N2O3/c1-3-6-15-13-11(14(17)18)7-9-4-5-10(19-2)8-12(9)16-13/h4-5,7-8H,3,6H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyCABOTJSXZISSBW-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.76
Rot. Bonds5

About 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid

7-methoxy-2-(propylamino)quinoline-3-carboxylic acid (PubChem CID 10400374) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid.

Molecular Properties

Compound Name7-methoxy-2-(propylamino)quinoline-3-carboxylic acid
PubChem CID10400374
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name7-methoxy-2-(propylamino)quinoline-3-carboxylic acid
SMILESCCCNc1nc2cc(OC)ccc2cc1C(=O)O
InChIInChI=1S/C14H16N2O3/c1-3-6-15-13-11(14(17)18)7-9-4-5-10(19-2)8-12(9)16-13/h4-5,7-8H,3,6H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyCABOTJSXZISSBW-UHFFFAOYSA-N
XLogP2.76
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminobutylamino)-7-methoxyquinoline-3-carboxylic acid
CID 10379413
7-methoxy-2-(2-morpholin-4-ylethylamino)quinoline-3-carboxylic acid
CID 10246128
7-methoxy-3-(methoxymethyl)-N-propylquinolin-2-amine
CID 62194206
5-methoxy-2-(propylamino)benzoic acid
CID 54594237
7-methoxy-3-(propan-2-yloxymethyl)-N-propylquinolin-2-amine
CID 62193913
2-(3-acetylanilino)-7-methoxyquinoline-3-carboxylic acid
CID 10449658
6-methoxy-2-(propylamino)quinoline-3-carbaldehyde
CID 86669817
6-methoxy-N,3-dipropylquinolin-2-amine
CID 63523658
2-O-ethyl 3-O-methyl 7-methoxyquinoline-2,3-dicarboxylate
CID 134910532
N-ethoxy-7-methoxy-2-methylquinoline-3-carboxamide
CID 18169112
7-methoxy-2-methyl-N-pentan-3-ylquinoline-3-carboxamide
CID 78829924
3-[ethyl-(7-methoxy-2-methylquinoline-3-carbonyl)amino]propanoic acid
CID 120516810

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid?
The IUPAC name of 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid (CID 10400374) is 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid.
What is the SMILES notation for 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid?
The canonical SMILES for 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid is CCCNc1nc2cc(OC)ccc2cc1C(=O)O.
What is the InChIKey of 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid?
The InChIKey is CABOTJSXZISSBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-3-6-15-13-11(14(17)18)7-9-4-5-10(19-2)8-12(9)16-13/h4-5,7-8H,3,6H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid?
7-methoxy-2-(propylamino)quinoline-3-carboxylic acid has a molecular weight of 260.29 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-(propylamino)quinoline-3-carboxylic acid is sourced from PubChem (CID 10400374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).