2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid

C18H11NO3 — CID 2731723

IUPAC2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccco2)nc2cc3ccccc3cc12
InChIInChI=1S/C18H11NO3/c20-18(21)14-10-16(17-6-3-7-22-17)19-15-9-12-5-2-1-4-11(12)8-13(14)15/h1-10H,(H,20,21)
InChIKeyBGXXKBHYPJKGJC-UHFFFAOYSA-N
MW289.29 g/mol
LogP4.35
Rot. Bonds2

About 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid

2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid (PubChem CID 2731723) has the molecular formula C18H11NO3 and a molecular weight of 289.29 g/mol. Its IUPAC name is 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid.

Molecular Properties

Compound Name2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid
PubChem CID2731723
Molecular FormulaC18H11NO3
Molecular Weight289.29 g/mol
Exact Mass289.07
IUPAC Name2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccco2)nc2cc3ccccc3cc12
InChIInChI=1S/C18H11NO3/c20-18(21)14-10-16(17-6-3-7-22-17)19-15-9-12-5-2-1-4-11(12)8-13(14)15/h1-10H,(H,20,21)
InChIKeyBGXXKBHYPJKGJC-UHFFFAOYSA-N
XLogP4.35
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.29
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-(Furan-2-yl)quinoline-4-carboxylic acid
CID 697640
Methyl 1-(2-(furan-2-yl)quinoline-4-carbonyl)piperidine-4-carboxylate
CID 2420130
6-Bromo-2-(2-furanyl)-4-quinolinecarboxylic acid
CID 686152
2-(5-Methylfuran-2-yl)quinoline-4-carboxylic acid
CID 693021
2-[(E)-[[2-(2-furyl)quinoline-4-carbonyl]hydrazono]methyl]benzoic acid
CID 6906548
(2-Amino-2-oxoethyl) 2-(furan-2-yl)quinoline-4-carboxylate
CID 2372589
Methyl 2-(5-methyl-2-furyl)-4-quinolinecarboxylate
CID 842067
2-(2-furyl)-N-(2-methylphenyl)-4-quinolinecarboxamide
CID 868692
6-Bromo-2-(2-furyl)-4-quinolinecarboxylic acid
CID 23672178
N-(2-fluorophenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 903245
6-Bromo-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid
CID 753116
2-Furan-2-yl-6,8-dimethyl-quinoline-4-carboxylic acid
CID 865220

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid?
The IUPAC name of 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid (CID 2731723) is 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid.
What is the SMILES notation for 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid?
The canonical SMILES for 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid is O=C(O)c1cc(-c2ccco2)nc2cc3ccccc3cc12.
What is the InChIKey of 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid?
The InChIKey is BGXXKBHYPJKGJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11NO3/c20-18(21)14-10-16(17-6-3-7-22-17)19-15-9-12-5-2-1-4-11(12)8-13(14)15/h1-10H,(H,20,21).
What are the key properties of 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid?
2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid has a molecular weight of 289.29 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)benzo[g]quinoline-4-carboxylic acid is sourced from PubChem (CID 2731723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).