3-quinolin-3-yloxypyridazine-4-carboxylic acid

C14H9N3O3 — CID 107387979

IUPAC3-quinolin-3-yloxypyridazine-4-carboxylic acid
SMILESO=C(O)c1ccnnc1Oc1cnc2ccccc2c1
InChIInChI=1S/C14H9N3O3/c18-14(19)11-5-6-16-17-13(11)20-10-7-9-3-1-2-4-12(9)15-8-10/h1-8H,(H,18,19)
InChIKeyDBNMKYYQWINBQX-UHFFFAOYSA-N
MW267.24 g/mol
LogP2.52
Rot. Bonds3

About 3-quinolin-3-yloxypyridazine-4-carboxylic acid

3-quinolin-3-yloxypyridazine-4-carboxylic acid (PubChem CID 107387979) has the molecular formula C14H9N3O3 and a molecular weight of 267.24 g/mol. Its IUPAC name is 3-quinolin-3-yloxypyridazine-4-carboxylic acid.

Molecular Properties

Compound Name3-quinolin-3-yloxypyridazine-4-carboxylic acid
PubChem CID107387979
Molecular FormulaC14H9N3O3
Molecular Weight267.24 g/mol
Exact Mass267.06
IUPAC Name3-quinolin-3-yloxypyridazine-4-carboxylic acid
SMILESO=C(O)c1ccnnc1Oc1cnc2ccccc2c1
InChIInChI=1S/C14H9N3O3/c18-14(19)11-5-6-16-17-13(11)20-10-7-9-3-1-2-4-12(9)15-8-10/h1-8H,(H,18,19)
InChIKeyDBNMKYYQWINBQX-UHFFFAOYSA-N
XLogP2.52
TPSA85.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.24
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-quinolin-3-yloxypyridazine-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

4-bromo-2-quinolin-3-yloxybenzoic acid
CID 107387489
2-amino-3-quinolin-3-yloxybenzoic acid
CID 107387664
3-(4-bromo-3,5-dimethylphenoxy)pyridazine-4-carboxylic acid
CID 107726786
3-(2-iodophenoxy)pyridazine-4-carboxylic acid
CID 80517144
2-naphthalen-2-yloxypyridine-3-carboxylic acid
CID 16784651
2-chloro-6-quinolin-3-yloxybenzoic acid
CID 107387494
3-[3-(methoxymethyl)phenoxy]pyridazine-4-carboxylic acid
CID 80518415
3-amino-4-quinolin-3-yloxybenzoic acid
CID 107387663
3-(1-bromonaphthalen-2-yl)oxypyridazine-4-carboxylic acid
CID 80515853
3-(4-nitrophenoxy)pyridazine-4-carboxylic acid
CID 80517221
3-quinolin-3-yloxypropanamide
CID 107388241
1-(2-amino-4-quinolin-3-yloxyphenyl)ethanone
CID 107386877

Frequently Asked Questions

What is the IUPAC name of 3-quinolin-3-yloxypyridazine-4-carboxylic acid?
The IUPAC name of 3-quinolin-3-yloxypyridazine-4-carboxylic acid (CID 107387979) is 3-quinolin-3-yloxypyridazine-4-carboxylic acid.
What is the SMILES notation for 3-quinolin-3-yloxypyridazine-4-carboxylic acid?
The canonical SMILES for 3-quinolin-3-yloxypyridazine-4-carboxylic acid is O=C(O)c1ccnnc1Oc1cnc2ccccc2c1.
What is the InChIKey of 3-quinolin-3-yloxypyridazine-4-carboxylic acid?
The InChIKey is DBNMKYYQWINBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N3O3/c18-14(19)11-5-6-16-17-13(11)20-10-7-9-3-1-2-4-12(9)15-8-10/h1-8H,(H,18,19).
What are the key properties of 3-quinolin-3-yloxypyridazine-4-carboxylic acid?
3-quinolin-3-yloxypyridazine-4-carboxylic acid has a molecular weight of 267.24 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-quinolin-3-yloxypyridazine-4-carboxylic acid is sourced from PubChem (CID 107387979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).