2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid

C15H11NO4 — CID 106535487

IUPAC2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid
SMILESCc1ccc(C(=O)O)c(Oc2nccc3occc23)c1
InChIInChI=1S/C15H11NO4/c1-9-2-3-11(15(17)18)13(8-9)20-14-10-5-7-19-12(10)4-6-16-14/h2-8H,1H3,(H,17,18)
InChIKeyVLRVDUBYGVFKAB-UHFFFAOYSA-N
MW269.26 g/mol
LogP3.63
Rot. Bonds3

About 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid

2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid (PubChem CID 106535487) has the molecular formula C15H11NO4 and a molecular weight of 269.26 g/mol. Its IUPAC name is 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid.

Molecular Properties

Compound Name2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid
PubChem CID106535487
Molecular FormulaC15H11NO4
Molecular Weight269.26 g/mol
Exact Mass269.07
IUPAC Name2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid
SMILESCc1ccc(C(=O)O)c(Oc2nccc3occc23)c1
InChIInChI=1S/C15H11NO4/c1-9-2-3-11(15(17)18)13(8-9)20-14-10-5-7-19-12(10)4-6-16-14/h2-8H,1H3,(H,17,18)
InChIKeyVLRVDUBYGVFKAB-UHFFFAOYSA-N
XLogP3.63
TPSA72.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-furo[3,2-c]pyridin-4-yloxypyridine-4-carboxylic acid
CID 106535499
4-methyl-2-pyrimidin-2-yloxybenzoic acid
CID 61395843
2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)oxy]-4-methylbenzoic acid
CID 114585672
2-(5-fluoro-6-methylpyrimidin-4-yl)oxy-4-methylbenzoic acid
CID 114045786
2-[(4-cyano-2-pyridinyl)oxy]-4-methylbenzoic acid
CID 61395798
4-methyl-2-(7H-purin-6-yloxy)benzoic acid
CID 61395763
2-(2-bromo-4-methylphenoxy)-4-methylbenzoic acid
CID 63513152
2-(4-methoxyphenoxy)-4-methylbenzoic acid
CID 55107428
2-(1,3-benzoxazol-2-yloxy)-4-methylbenzoic acid
CID 61395834
2-[(5-bromo-2-pyridinyl)oxy]-4-methylbenzoic acid
CID 61395820
3-fluoro-2-(5-methyl-2-propan-2-ylphenoxy)pyridine-4-carboxylic acid
CID 105379913
4-methyl-2-quinolin-7-yloxybenzoic acid
CID 107313379

Frequently Asked Questions

What is the IUPAC name of 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid?
The IUPAC name of 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid (CID 106535487) is 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid.
What is the SMILES notation for 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid?
The canonical SMILES for 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid is Cc1ccc(C(=O)O)c(Oc2nccc3occc23)c1.
What is the InChIKey of 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid?
The InChIKey is VLRVDUBYGVFKAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO4/c1-9-2-3-11(15(17)18)13(8-9)20-14-10-5-7-19-12(10)4-6-16-14/h2-8H,1H3,(H,17,18).
What are the key properties of 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid?
2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid has a molecular weight of 269.26 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-furo[3,2-c]pyridin-4-yloxy-4-methylbenzoic acid is sourced from PubChem (CID 106535487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).